Beta-lactoglobulin fibrils
OrganismNot specified
State in the Current Structure
| Assembly | Oligomeric State | Construct | Mutations and Modifications | Ligands, Ions and Associated Components | Method and Experimental Conditions | Structure Quality |
|---|---|---|---|---|---|---|
| 1 | Protein homooligomer Homooligomer Protein × 6 PDB declaration: hexameric（6） Consistent with protein copy count | Chain AA； UniProt 17–48 Chain AB； UniProt 17–48 Chain AC； UniProt 17–48 Chain AD； UniProt 17–48 Chain AE； UniProt 17–48 Chain AF； UniProt 17–48 | Not recorded | No other associated polymer | ELECTRON MICROSCOPY cryo-EM buffer：pH 2 cryo-EM vitrification conditions：Cryogen ETHANE | Resolution 3.73 Å |
Other States of the Same Protein in the Database
Each row is a biological assembly of the same UniProt protein in another PDB entry. The “Difference from current entry” column identifies evidence-level differences; no tag means the currently parsed fields agree.
| Other PDB | Difference from Current Entry 9JHI | Assembly / Oligomeric State | Construct | Mutations and Modifications | Ligands, Ions and Non-polymers | Method and Experimental Conditions | Structure Quality |
|---|---|---|---|---|---|---|---|
| 1B0O BOVINE BETA-LACTOGLOBULIN COMPLEXED WITH PALMITATE, LATTICE Z Deposited 1998-11-11 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | PLM PALMITIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.5；pH 7.5
|
Resolution 2.50 Å R-free 0.240 |
| 1B8E HIGH RESOLUTION CRYSTAL STRUCTURE OF THE BOVINE BETA-LACTOGLOBULIN (ISOFORMS A AND B) IN ORTHOROMBIC SPACE GROUP Deposited 1999-01-30 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.9；METHOD IN PRESENCE OF AMMONIUM SULPHATE 2.5 M, 180MM TRIZMA BUFFER AT A PROTEIN CONCENTRATION OF 20MG/ML, pH 7.9, VAPOR DIFFUSION, HANGING DROP
|
Resolution 1.95 Å R-free 0.252 |
| 1BEB BOVINE BETA-LACTOGLOBULIN, LATTICE X Deposited 1996-12-20 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
batch method；pH 6.5；25MG/ML PROTEIN WAS DISSOLVED IN 0.1M SODIUM/ POTASSIUM PHOSPHATE BUFFER (PH 7.0) AND CRYSTALLIZED BY THE BATCH METHOD FROM 2M AMMONIUM SULFATE (PH 6.5) AND 0.4M SODIUM/POTASSIUM PHOSPHATE BUFFER (PH 7.6)., batch method
|
Resolution 1.80 Å R-free 0.243 |
| 1BEB BOVINE BETA-LACTOGLOBULIN, LATTICE X Deposited 1996-12-20 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain B
17–178（162 aa）
|
Not recorded | SO4 SULFATE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
batch method；pH 6.5；25MG/ML PROTEIN WAS DISSOLVED IN 0.1M SODIUM/ POTASSIUM PHOSPHATE BUFFER (PH 7.0) AND CRYSTALLIZED BY THE BATCH METHOD FROM 2M AMMONIUM SULFATE (PH 6.5) AND 0.4M SODIUM/POTASSIUM PHOSPHATE BUFFER (PH 7.6)., batch method
|
Resolution 1.80 Å R-free 0.243 |
| 1BSO 12-BROMODODECANOIC ACID BINDS INSIDE THE CALYX OF BOVINE BETA-LACTOGLOBULIN Deposited 1998-08-29 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | BRC 12-BROMODODECANOIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.3；PROTEIN WAS CRYSTALLIZED FROM AMMONIUM SULFATE, pH 7.3
|
Resolution 2.23 Å R-free 0.276 |
| 1BSQ STRUCTURAL AND FUNCTIONAL CONSEQUENCES OF POINT MUTATIONS OF VARIANTS A AND B OF BOVINE BETA-LACTOGLOBULIN Deposited 1998-08-29 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Mutation：VARIANT B | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.1；PROTEIN WAS CRYSTALLIZED FROM AMMONIUM SULFATE; PH 7.1
|
Resolution 2.22 Å R-free 0.286 |
| 1BSY STRUCTURAL BASIS OF THE TANFORD TRANSITION OF BOVINE BETA-LACTOGLOBULIN FROM CRYSTAL STRUCTURES AT THREE PH VALUES; PH 7.1 Deposited 1998-08-31 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.1；pH 7.1
|
Resolution 2.24 Å R-free 0.279 |
| 1CJ5 BOVINE BETA-LACTOGLOBULIN A Deposited 1999-04-22 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
19–178（160 aa）
|
Mutation：VARIANT A (LEU1-ILE2-VAL3 WAS MODIFIED TO GLU(-3)-ALA(-2)-GLU(-1)-ALA1-TYR2- VAL3) ) | No recorded non-water small molecule |
SOLUTION NMR
NMR measurement conditions
pH 2；318 K；Ionic strength (raw mmCIF value) 0.02；Pressure 1
NMR sample composition
5% WATER/95% D2O
|
Resolution not provided |
| 1DV9 STRUCTURAL CHANGES ACCOMPANYING PH-INDUCED DISSOCIATION OF THE B-LACTOGLOBULIN DIMER Deposited 2000-01-20 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
SOLUTION NMR
NMR measurement conditions
pH 2.7；310 K；Ionic strength (raw mmCIF value) not known；Pressure ambient
NMR sample composition
1mM B-lactoglobuline-15N,13C; 50mM phosphate buffer; 90% H2O, 10% D2O | 90% H2O/10% D2O
|
Resolution not provided |
| 1GX8 BOVINE BETA-LACTOGLOBULIN COMPLEXED WITH RETINOL, TRIGONAL LATTICE Z Deposited 2002-03-29 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | RTL RETINOL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.3；290 K；17 DEG C, 8MUL BLG-RET COMPLEX 20MM TRIS, PH 8 + 8MUL NA CITRATE 1.25M, 0.1M HEPES, PH7.3 DROP
|
Resolution 2.40 Å R-free 0.306 |
| 1GX9 BOVINE BETA-LACTOGLOBULIN COMPLEXED WITH RETINOIC ACID, TRIGONAL LATTICE Z Deposited 2002-03-29 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | REA RETINOIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.3；290 K；17 DEG C, 8MUL BLG-RET COMPLEX 20MM TRIS, PH 8 + 8MUL NA CITRATE 1.25M, 0.1M HEPES, PH7.3, PER DROP
|
Resolution 2.34 Å R-free 0.298 |
| 1GXA BOVINE BETA-LACTOGLOBULIN COMPLEXED WITH RETINOL AND PALMITIC ACID, TRIGONAL LATTICE Z Deposited 2002-04-01 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | PLM PALMITIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.3；290 K；17 DEG C, 8MUL BLG-RET-PLM COMPLEX 20MM TRIS, PH 8 + 8MUL NA CITRATE 1.25M, 0.1M HEPES, PH7.3, PER DROP
|
Resolution 2.35 Å R-free 0.301 |
| 1QG5 HIGH RESOLUTION CRYSTAL STRUCTURE OF THE BOVINE BETA-LACTOGLOBULIN (ISOFORM A) Deposited 1999-04-20 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.9；THE CRYSTAL WAS GROWN AT PH 7.9, HANGING DROP METHOD. DROP CONTAINED 2.5M (NH4)
2SO4, 180MM TRIZMA BUFFER, AND 20MG/ML PROTEIN REMARK 290, VAPOR DIFFUSION, HANGING DROP
|
Resolution 2.00 Å R-free 0.287 |
| 1UZ2 The Cys121Ser Mutant of Beta-Lactoglobulin Deposited 2004-03-03 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain X
17–178（162 aa）
|
Mutation：YES | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；HANGING DROPS WITH 20 MG/ML PROTEIN PLUS APPROX 2M AMMONIUM SULPHATE, 10MM HEPES, PH 7.5
|
Resolution 1.95 Å R-free 0.267 |
| 2AKQ The structure of bovine B-lactoglobulin A in crystals grown at very low ionic strength Deposited 2005-08-03 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Chain B
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
MICRODIALYSIS；pH 5.2；295 K；Ultra pure water, pH 5.20, MICRODIALYSIS, temperature 295K
|
Resolution 3.00 Å R-free 0.266 |
| 2AKQ The structure of bovine B-lactoglobulin A in crystals grown at very low ionic strength Deposited 2005-08-03 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain C
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
MICRODIALYSIS；pH 5.2；295 K；Ultra pure water, pH 5.20, MICRODIALYSIS, temperature 295K
|
Resolution 3.00 Å R-free 0.266 |
| 2AKQ The structure of bovine B-lactoglobulin A in crystals grown at very low ionic strength Deposited 2005-08-03 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 3 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain D
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
MICRODIALYSIS；pH 5.2；295 K；Ultra pure water, pH 5.20, MICRODIALYSIS, temperature 295K
|
Resolution 3.00 Å R-free 0.266 |
| 2BLG STRUCTURAL BASIS OF THE TANFORD TRANSITION OF BOVINE BETA-LACTOGLOBULIN FROM CRYSTAL STRUCTURES AT THREE PH VALUES; PH 8.2 Deposited 1998-08-29 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 8.2；pH 8.2
|
Resolution 2.46 Å R-free 0.277 |
| 2GJ5 Crystal structure of a secondary vitamin D3 binding site of milk beta-lactoglobulin Deposited 2006-03-30 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | VD3 (1S,3Z)-3-[(2E)-2-[(1R,3AR,7AS)-7A-METHYL-1-[(2R)-6-METHYLHEPTAN-2-YL]-2,3,3A,5,6,7-HEXAHYDRO-1H-INDEN-4-YLIDENE]ETHYLI DENE]-4-METHYLIDENE-CYCLOHEXAN-1-OL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；0.1M HEPES, 1.4M tri-sodium citrate dehydrate, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.40 Å R-free 0.298 |
| 2Q2M Beta-lactoglobulin (native) Deposited 2007-05-29 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.4；293 K；0.01M hepes, 2.2 to 2.8 M Ammonium sulphate, NAOH, pH 7.40, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.10 Å R-free 0.268 |
| 2Q2P Beta-lactoglobulin (reverse native) Deposited 2007-05-29 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.4；293 K；0.01M Hepes, 2.2 to 2.8 M Ammonium sulphate, NAOH, pH 7.40, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.96 Å R-free 0.242 |
| 2Q39 Beta-lactoglobulin (low humidity) Deposited 2007-05-30 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Chain B
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.4；293 K；0.01M hepes, 2.2 to 2.8 M Ammonium sulphate, NAOH, pH 7.40, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.50 Å R-free 0.306 |
| 2R56 Crystal Structure of a Recombinant IgE Fab Fragment in Complex with Bovine Beta-Lactoglobulin Allergen Deposited 2007-09-03 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein heterocomplex Heteromer；Protein × 6 PDB declaration: hexameric |
Chain A
17–178（162 aa）
Chain B
17–178（162 aa）
|
Not recorded | LMT DODECYL-BETA-D-MALTOSIDE × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 5.5；293 K；14 % PEG3350, 0.1 M BTP, n-dodecyl-beta-D-maltoside, pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.80 Å R-free 0.291 |
| 3BLG STRUCTURAL BASIS OF THE TANFORD TRANSITION OF BOVINE BETA-LACTOGLOBULIN FROM CRYSTAL STRUCTURES AT THREE PH VALUES; PH 6.2 Deposited 1998-08-29 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 6.2；pH 6.2
|
Resolution 2.56 Å R-free 0.240 |
| 3KZA Crystal structure of Gyuba, a patched chimera of b-lactglobulin Deposited 2009-12-08 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Insufficient information Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
33–43（11 aa）
Chain A
58–65（8 aa）
Chain A
68–78（11 aa）
Chain A
82–89（8 aa）
Chain A
96–102（7 aa）
Chain A
105–111（7 aa）
Chain A
118–124（7 aa）
Chain A
133–140（8 aa）
Chain A
146–154（9 aa）
Chain A
161–169（9 aa）
Chain B
33–43（11 aa）
Chain B
58–65（8 aa）
Chain B
68–78（11 aa）
Chain B
82–89（8 aa）
Chain B
96–102（7 aa）
Chain B
105–111（7 aa）
Chain B
118–124（7 aa）
Chain B
133–140（8 aa）
Chain B
146–154（9 aa）
Chain B
161–169（9 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7；293 K；2.0M ammonium sulfate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.00 Å R-free 0.285 |
| 3KZA Crystal structure of Gyuba, a patched chimera of b-lactglobulin Deposited 2009-12-08 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Insufficient information Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
33–43（11 aa）
Chain A
58–65（8 aa）
Chain A
68–78（11 aa）
Chain A
82–89（8 aa）
Chain A
96–102（7 aa）
Chain A
105–111（7 aa）
Chain A
118–124（7 aa）
Chain A
133–140（8 aa）
Chain A
146–154（9 aa）
Chain A
161–169（9 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7；293 K；2.0M ammonium sulfate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.00 Å R-free 0.285 |
| 3KZA Crystal structure of Gyuba, a patched chimera of b-lactglobulin Deposited 2009-12-08 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 3 Insufficient information Monomer；Protein × 1 PDB declaration: monomeric |
Chain B
33–43（11 aa）
Chain B
58–65（8 aa）
Chain B
68–78（11 aa）
Chain B
82–89（8 aa）
Chain B
96–102（7 aa）
Chain B
105–111（7 aa）
Chain B
118–124（7 aa）
Chain B
133–140（8 aa）
Chain B
146–154（9 aa）
Chain B
161–169（9 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7；293 K；2.0M ammonium sulfate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.00 Å R-free 0.285 |
| 3NPO Bovine beta lactoglobulin unliganded form Deposited 2010-06-28 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M trisodium citrate, 0.1M Tris-HCl buffer, 96% ethanol, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K
|
Resolution 2.20 Å R-free 0.260 |
| 3NQ3 Bovine beta-lactoglobulin complex with capric acid Deposited 2010-06-29 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | DKA DECANOIC ACID × 1 GOL GLYCEROL × 1 CL CHLORIDE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M trisodium citrate, 0.1M Tris-HCl buffer, 1mM capric acid in 96% ethanol , pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 1.90 Å R-free 0.289 |
| 3NQ9 Bovine beta-lactoglobulin complex with caprylic acid Deposited 2010-06-29 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | OCA OCTANOIC ACID (CAPRYLIC ACID) × 1 CL CHLORIDE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M trisodium citrate, 0.1M Tris-HCl buffer, 10mM caprylic acid in 96% ethanol , pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 1.90 Å R-free 0.309 |
| 3PH5 Bovine beta lactoglobulin crystallized through ligandation of yttrium cations Deposited 2010-11-03 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
18–178（161 aa）
Fragment：unp residues 18-178
|
Not recorded | YT3 YTTRIUM (III) ION × 2 CL CHLORIDE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
Batch Crystallization；pH 7；277 K；Crystallized in presents of 3.0 mM yttrium(III) chlorid, pH 7, Batch Crystallization, temperature 277K
|
Resolution 2.40 Å R-free 0.263 |
| 3PH5 Bovine beta lactoglobulin crystallized through ligandation of yttrium cations Deposited 2010-11-03 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain B
18–178（161 aa）
Fragment：unp residues 18-178
|
Not recorded | YT3 YTTRIUM (III) ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
Batch Crystallization；pH 7；277 K；Crystallized in presents of 3.0 mM yttrium(III) chlorid, pH 7, Batch Crystallization, temperature 277K
|
Resolution 2.40 Å R-free 0.263 |
| 3PH6 Bovine beta lactoglobulin crytsallized through ligandation of yttrium Deposited 2010-11-03 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
18–178（161 aa）
Fragment：unp residues 18-178
|
Not recorded | YT3 YTTRIUM (III) ION × 2 CL CHLORIDE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
Batch crystallization；pH 7；277 K；0.3 mM Yttrium, pH 7, Batch crystallization, temperature 277K
|
Resolution 2.53 Å R-free 0.265 |
| 3PH6 Bovine beta lactoglobulin crytsallized through ligandation of yttrium Deposited 2010-11-03 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain B
18–178（161 aa）
Fragment：unp residues 18-178
|
Not recorded | YT3 YTTRIUM (III) ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
Batch crystallization；pH 7；277 K；0.3 mM Yttrium, pH 7, Batch crystallization, temperature 277K
|
Resolution 2.53 Å R-free 0.265 |
| 3UEU Bovine beta-lactoglobulin complex with lauric acid Deposited 2011-10-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | DAO LAURIC ACID × 2 CL CHLORIDE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34 M trisodium citrarte, 0.1 Tris-HCl buffer, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.10 Å R-free 0.255 |
| 3UEV Bovine beta-lactoglobulin complex with myristic acid Deposited 2011-10-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | MYR MYRISTIC ACID × 2 GOL GLYCEROL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34 M trisodium citrate, 0.1 M Tris-HCl buffer, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 1.90 Å R-free 0.275 |
| 3UEV Bovine beta-lactoglobulin complex with myristic acid Deposited 2011-10-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | MYR MYRISTIC ACID × 1 GOL GLYCEROL × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34 M trisodium citrate, 0.1 M Tris-HCl buffer, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 1.90 Å R-free 0.275 |
| 3UEW Bovine beta-lactoglobulin complex with palmitic acid Deposited 2011-10-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | PLM PALMITIC ACID × 2 EOH ETHANOL × 6 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34 M trisodium citrate, 0.1 M Tris-HCl buffer, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.00 Å R-free 0.266 |
| 3UEW Bovine beta-lactoglobulin complex with palmitic acid Deposited 2011-10-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | PLM PALMITIC ACID × 1 EOH ETHANOL × 3 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34 M trisodium citrate, 0.1 M Tris-HCl buffer, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.00 Å R-free 0.266 |
| 3UEX Bovine beta-lactoglobulin complex with stearic acid Deposited 2011-10-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | STE STEARIC ACID × 2 EOH ETHANOL × 6 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34 M trisodium citrarte, 0.1 Tris-HCl buffer, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 239K, temperature 293K
|
Resolution 2.10 Å R-free 0.284 |
| 3UEX Bovine beta-lactoglobulin complex with stearic acid Deposited 2011-10-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | STE STEARIC ACID × 1 EOH ETHANOL × 3 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34 M trisodium citrarte, 0.1 Tris-HCl buffer, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 239K, temperature 293K
|
Resolution 2.10 Å R-free 0.284 |
| 4DQ3 Bovine beta-lactoglobulin complex with oleic acid Deposited 2012-02-15 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | OLA OLEIC ACID × 2 EOH ETHANOL × 2 GOL GLYCEROL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；0.1M Tris-HCl buffer, 1.34M tri-sodium citrate, 1mM oleic acid in ethanol, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.10 Å R-free 0.289 |
| 4DQ3 Bovine beta-lactoglobulin complex with oleic acid Deposited 2012-02-15 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | OLA OLEIC ACID × 1 EOH ETHANOL × 1 GOL GLYCEROL × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；0.1M Tris-HCl buffer, 1.34M tri-sodium citrate, 1mM oleic acid in ethanol, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.10 Å R-free 0.289 |
| 4DQ4 Bovine beta-lactoglobulin complex with linoleic acid Deposited 2012-02-15 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | EIC LINOLEIC ACID × 2 GOL GLYCEROL × 2 EOH ETHANOL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；0.1M Tris-HCl buffer, 1.34M tri-sodium citrate, 1mM linoleic acid in ethanol, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.10 Å R-free 0.290 |
| 4DQ4 Bovine beta-lactoglobulin complex with linoleic acid Deposited 2012-02-15 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | EIC LINOLEIC ACID × 1 GOL GLYCEROL × 1 EOH ETHANOL × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；0.1M Tris-HCl buffer, 1.34M tri-sodium citrate, 1mM linoleic acid in ethanol, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.10 Å R-free 0.290 |
| 4GNY Bovine beta-lactoglobulin complex with dodecyl sulfate Deposited 2012-08-17 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | SDS DODECYL SULFATE × 2 GOL GLYCEROL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.4；291 K；1.34 M trisodium citrate in 0.05 M Tris-HCl buffer, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 291K
|
Resolution 1.64 Å R-free 0.226 |
| 4IB6 Bovine beta-lactoglobulin (isoform A) in complex with lauric acid (C12) Deposited 2012-12-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | DAO LAURIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M TRISODIUM CITRATE, 0.1M TRIS-HCL BUFFER, PH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.20 Å R-free 0.268 |
| 4IB7 Bovine beta-lactoglobulin (isoform A) in complex with dodecyltrimethylammonium (DTAC) Deposited 2012-12-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | CAT DODECANE-TRIMETHYLAMINE × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M TRISODIUM CITRATE, 0.1M TRIS-HCL BUFFER, PH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.20 Å R-free 0.309 |
| 4IB8 Bovine beta-lactoglobulin (isoform A) in complex with dodecyl sulphate (SDS) Deposited 2012-12-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | SDS DODECYL SULFATE × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M TRISODIUM CITRATE, 0.1M TRIS-HCL BUFFER, PH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.30 Å R-free 0.285 |
| 4IB9 Bovine beta-lactoglobulin (isoform B) in complex with dodecyltrimethylammonium (DTAC) Deposited 2012-12-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | CAT DODECANE-TRIMETHYLAMINE × 2 GOL GLYCEROL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M TRISODIUM CITRATE, 0.1M TRIS-HCL BUFFER, PH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.20 Å R-free 0.306 |
| 4IB9 Bovine beta-lactoglobulin (isoform B) in complex with dodecyltrimethylammonium (DTAC) Deposited 2012-12-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | CAT DODECANE-TRIMETHYLAMINE × 2 GOL GLYCEROL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M TRISODIUM CITRATE, 0.1M TRIS-HCL BUFFER, PH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.20 Å R-free 0.306 |
| 4IBA Bovine beta-lactoglobulin (isoform B) in complex with dodecyl sulphate (SDS) Deposited 2012-12-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | SDS DODECYL SULFATE × 2 GOL GLYCEROL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.34M TRISODIUM CITRATE, 0.1M TRIS-HCL BUFFER, PH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 2.30 Å R-free 0.281 |
| 4KII Beta-lactoglobulin in complex with Cp*Rh(III)Cl N,N-di(pyridin-2-yl)dodecanamide Deposited 2013-05-02 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | RHL [N,N-di(pyridin-2-yl-kappaN)dodecanamide]rhodium × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；1.44 M trisodium citrate
100 mM Tris HCl pH 7.5 , VAPOR DIFFUSION, HANGING DROP, temperature 293K
|
Resolution 1.85 Å R-free 0.220 |
| 4LZU Bovine beta-lactoglobulin crystallized in the presence of 2 mM zinc chloride Deposited 2013-08-01 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | ZN ZINC ION × 4 |
X-RAY DIFFRACTION
X-ray crystallization conditions
BATCH；pH 6；277 K；2 mM zinc chloride, pH 6.0, BATCH, temperature 277K
|
Resolution 2.40 Å R-free 0.231 |
| 4LZV Bovine beta-lactoglobulin crystallized in the presence of 20 mM zinc chloride Deposited 2013-08-01 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP residues 17-178
|
Not recorded | ZN ZINC ION × 6 |
X-RAY DIFFRACTION
X-ray crystallization conditions
BATCH；pH 5.9；277 K；20 mM zinc chloride, pH 5.9, BATCH, temperature 277K
|
Resolution 2.44 Å R-free 0.233 |
| 4Y0P Bovine beta-lactoglobulin complex with tetracaine (BLG-TET) Deposited 2015-02-06 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：UNP RESIDUES 17-178
|
Not recorded | TE4 Tetracaine × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；protein 20 mg/ml, 1.34 M sodium citrate in 0.1 M Tris-HCl pH 7.5 and 5 mM tetracaine
|
Resolution 2.20 Å R-free 0.265 |
| 4Y0Q Bovine beta-lactoglobulin complex with pramocaine crystallized from sodium citrate (BLG-PRM1) Deposited 2015-02-06 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | PX9 Pramocaine × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；protein 20 mg/ml, 1.34 M sodium citrate in 0.1 M Tris-HCl pH 7.5
|
Resolution 2.00 Å R-free 0.278 |
| 4Y0R Bovine beta-lactoglobulin complex with pramocaine crystallized from ammonium sulphate (BLG-PRM2) Deposited 2015-02-06 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Fragment：unp residues 17-178
|
Not recorded | PX9 Pramocaine × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；protein 20 mg/ml, 2.4 M (NH4)2SO4 in 0.5 M Tris-HCl pH 8.9 and 5 mM pramociane
|
Resolution 2.30 Å R-free 0.285 |
| 5HTD Recombinant bovine beta-lactoglobulin variant L1A/I2S with endogenous ligand (sBlgB#1) Deposited 2016-01-26 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A I2S | MYR MYRISTIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；298 K；1.34 M sodium citrate in 0.1 M Tris pH 7.5
|
Resolution 2.50 Å R-free 0.272 |
| 5HTE Recombinant bovine beta-lactoglobulin variant L1A/I2S (sBlgB#2) Deposited 2016-01-26 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A I2S | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；298 K；2.3 M (NH4)2SO4 in 0.5 M Tris-HCl pH 8.5
|
Resolution 2.40 Å R-free 0.303 |
| 5IO5 Unliganded form of bovine beta-lactoglobulin, ambient pressure Deposited 2016-03-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | CL CHLORIDE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；298 K；1.34 M citric sodium pH 7.5
|
Resolution 2.85 Å R-free 0.295 |
| 5IO7 Bovine beta-lactoglobulin complex with dodecane at high pressure (0.43 GPa) Deposited 2016-03-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | D12 DODECANE × 1 CL CHLORIDE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；298 K；1.34 M citric sodium
|
Resolution 2.85 Å R-free 0.229 |
| 5K06 Recombinant bovine beta-lactoglobulin with uncleaved N-terminal methionine (rBlgB) Deposited 2016-05-17 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Not recorded | GOL GLYCEROL × 2 MYR MYRISTIC ACID × 2 SIN SUCCINIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；3.0 M (NH4)2SO4 solution in 0.2 M Tris-HCl buffer, pH from 7.8 to 8.8
|
Resolution 2.50 Å R-free 0.324 |
| 5LKE Bovine beta-lactoglobulin complex with myristic acid, ambient pressure Deposited 2016-07-22 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | MYR MYRISTIC ACID × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；298 K；1.34 M CITRIC SODIUM, 0.1 Tris-HCL, PH 7.5,
|
Resolution 2.80 Å R-free 0.313 |
| 5LKF Bovine beta-lactoglobulin complex with myristic acid at high pressure (0.55 GPa) Deposited 2016-07-22 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | MYR MYRISTIC ACID × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；298 K；1.34 M CITRIC SODIUM, 0.1 M TRIS-HCL,
|
Resolution 2.50 Å R-free 0.398 |
| 5NUJ Engineered beta-lactoglobulin: variant I56F-L39A in complex with chlorpromazine (LG-FA-CLP) Deposited 2017-04-30 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, I56F, L39A | Z80 3-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropan-1-amine × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；2.80 M (NH4)2SO4 in 0.1 M Tris-HCl, pH 8.0
|
Resolution 2.60 Å R-free 0.331 |
| 5NUK Engineered beta-lactoglobulin: variant I56F-L39A-M107F in complex with chlorpromazine (LG-FAF-CLP) Deposited 2017-04-30 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, I56F, L39A, M107F | Z80 3-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropan-1-amine × 2 SO4 SULFATE ION × 2 GOL GLYCEROL × 2 PO4 PHOSPHATE ION × 2 CL CHLORIDE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；2.80 M (NH4)2SO4, 0.1 M Tris pH 8.0
|
Resolution 1.70 Å R-free 0.269 |
| 5NUM Engineered beta-lactoglobulin: variant F105L-L39A in complex with chlorpromazine (LG-LA-CLP) Deposited 2017-04-30 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, L39A, F105L | Z80 3-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropan-1-amine × 2 PO4 PHOSPHATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；2.60 M (NH4)2SO4 in 0.1 M Tris-HCl, pH 8.0
|
Resolution 2.30 Å R-free 0.289 |
| 5NUN Engineered beta-lactoglobulin: variant F105L-L39A-M107F in complex with chlorpromazine (LG-LAF-CLP) Deposited 2017-04-30 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, L39a, F105L, M107F | Z80 3-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropan-1-amine × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；2.40 M (NH4)2SO4 in 0.1 M Tris-HCl, pH 8.0
|
Resolution 1.95 Å R-free 0.262 |
| 5Y5C Crystal structure of dha bind to bovine beta-lactoglobulin Deposited 2017-08-08 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION；pH 7.5；289 K；1.34M trisodium citrate, 0.1M Tris
|
Resolution 2.61 Å R-free 0.244 |
| 5Y5C Crystal structure of dha bind to bovine beta-lactoglobulin Deposited 2017-08-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain B
17–178（162 aa）
|
Not recorded | HXA DOCOSA-4,7,10,13,16,19-HEXAENOIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION；pH 7.5；289 K；1.34M trisodium citrate, 0.1M Tris
|
Resolution 2.61 Å R-free 0.244 |
| 6GE7 Thermodynamic, Crystallographic and Computational Studies of Non Mammalian Fatty Acid Binding to Bovine b-Lactoglobulin Deposited 2018-04-25 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | EW8 nonadecanoic acid × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293.2 K；protein 20 mg/mL, ligand 10mM, 20mM Tris buffer, pH 8, which were mixed with 4 microliter of well solution. Drops were equilibrated against 1 mL of well solution containing 1.43 M sodium citrate and 0.1M Hepes, pH 7.5
|
Resolution 2.30 Å R-free 0.248 |
| 6GF9 Thermodynamic, Crystallographic and Computational Studies of Non Mammalian Fatty Acid Binding to Bovine b-Lactoglobulin Deposited 2018-04-29 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | X90 heptadecanoic acid × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293.2 K；protein 20 mg/mL, ligand 10mM, 20mM Tris buffer, pH 8, which were mixed with 4 microliter of well solution. Drops were equilibrated against 1 mL of well solution containing 1.43 M sodium citrate and 0.1M Hepes, pH 7.5
|
Resolution 2.10 Å R-free 0.245 |
| 6GFS Thermodynamic, Crystallographic and Computational Studies of Non Mammalian Fatty Acid Binding to Bovine b-Lactoglobulin Deposited 2018-05-02 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | F15 PENTADECANOIC ACID × 1 CL CHLORIDE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293.2 K；protein 20 mg/mL, ligand 10mM, 20mM Tris buffer, pH 8, which were mixed with 4 microliter of well solution. Drops were equilibrated against 1 mL of well solution containing 1.43 M sodium citrate and 0.1M Hepes, pH 7.5
|
Resolution 2.00 Å R-free 0.248 |
| 6GHH Thermodynamic, Crystallographic and Computational Studies of Non Mammalian Fatty Acid Binding to Bovine b-Lactoglobulin Deposited 2018-05-07 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | TDA N-TRIDECANOIC ACID × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.3；293.2 K；protein 20 mg/mL, ligand 10mM, 20mM Tris buffer, pH 8, which were mixed with 4 microliter of well solution. Drops were equilibrated against 1 mL of well solution containing 1.43 M sodium citrate and 0.1M Hepes, pH 7.5
|
Resolution 1.90 Å R-free 0.248 |
| 6NKQ The structure of bovine beta-lactoglobulin in novel crystals grown at pH 3.8 Deposited 2019-01-07 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain B
1–178（178 aa）
|
Not recorded | CA CALCIUM ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 3.8；293 K；Reservoir of 3 M NaCl buffered with sodium citrate at pH 3.8 - heavy white precipitate formed upon mixing of 30 mg/ml protein in water with reservoir solution. Precipitate was removed by centrifugation. The clear remaining 12ul droplet was equilibrated against the reservoir for 12 to 60 hours
|
Resolution 2.30 Å R-free 0.261 |
| 6NKQ The structure of bovine beta-lactoglobulin in novel crystals grown at pH 3.8 Deposited 2019-01-07 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain C
1–178（178 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 3.8；293 K；Reservoir of 3 M NaCl buffered with sodium citrate at pH 3.8 - heavy white precipitate formed upon mixing of 30 mg/ml protein in water with reservoir solution. Precipitate was removed by centrifugation. The clear remaining 12ul droplet was equilibrated against the reservoir for 12 to 60 hours
|
Resolution 2.30 Å R-free 0.261 |
| 6NKQ The structure of bovine beta-lactoglobulin in novel crystals grown at pH 3.8 Deposited 2019-01-07 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 3 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain D
1–178（178 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 3.8；293 K；Reservoir of 3 M NaCl buffered with sodium citrate at pH 3.8 - heavy white precipitate formed upon mixing of 30 mg/ml protein in water with reservoir solution. Precipitate was removed by centrifugation. The clear remaining 12ul droplet was equilibrated against the reservoir for 12 to 60 hours
|
Resolution 2.30 Å R-free 0.261 |
| 6NKQ The structure of bovine beta-lactoglobulin in novel crystals grown at pH 3.8 Deposited 2019-01-07 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 4 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain E
1–178（178 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 3.8；293 K；Reservoir of 3 M NaCl buffered with sodium citrate at pH 3.8 - heavy white precipitate formed upon mixing of 30 mg/ml protein in water with reservoir solution. Precipitate was removed by centrifugation. The clear remaining 12ul droplet was equilibrated against the reservoir for 12 to 60 hours
|
Resolution 2.30 Å R-free 0.261 |
| 6NKQ The structure of bovine beta-lactoglobulin in novel crystals grown at pH 3.8 Deposited 2019-01-07 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 5 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain F
1–178（178 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 3.8；293 K；Reservoir of 3 M NaCl buffered with sodium citrate at pH 3.8 - heavy white precipitate formed upon mixing of 30 mg/ml protein in water with reservoir solution. Precipitate was removed by centrifugation. The clear remaining 12ul droplet was equilibrated against the reservoir for 12 to 60 hours
|
Resolution 2.30 Å R-free 0.261 |
| 6NKQ The structure of bovine beta-lactoglobulin in novel crystals grown at pH 3.8 Deposited 2019-01-07 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 6 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
1–178（178 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 3.8；293 K；Reservoir of 3 M NaCl buffered with sodium citrate at pH 3.8 - heavy white precipitate formed upon mixing of 30 mg/ml protein in water with reservoir solution. Precipitate was removed by centrifugation. The clear remaining 12ul droplet was equilibrated against the reservoir for 12 to 60 hours
|
Resolution 2.30 Å R-free 0.261 |
| 6QI6 Trigonal form of WT recombinant bovine beta-lactoglobulin Deposited 2019-01-17 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S | EDO 1,2-ETHANEDIOL × 4 EOH ETHANOL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；297 K；2.80 M (NH4)2SO4 in 0.1 M Tris-HCl pH 8.0
|
Resolution 2.00 Å R-free 0.246 |
| 6QI7 Engineered beta-lactoglobulin: variant L39Y in complex with endogenous ligand Deposited 2019-01-17 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, L39Y | PLM PALMITIC ACID × 2 EDO 1,2-ETHANEDIOL × 6 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；2.60 M (NH4)2SO4 in 0.1 M Tris-HCl pH 7.1
|
Resolution 2.50 Å R-free 0.262 |
| 6QPD Engineered beta-lactoglobulin: variant I56F Deposited 2019-02-13 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, I56F | SO4 SULFATE ION × 2 GOL GLYCEROL × 4 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；2.60 M (NH4)2SO4 in 0.1 M Tris-HCl pH 8.0
|
Resolution 2.00 Å R-free 0.269 |
| 6QPE Engineered beta-lactoglobulin: variant L58F Deposited 2019-02-13 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, L58F | ACT ACETATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；2.80 M (NH4)2SO4 in 0.1 M Tris-HCl pH 8.0
|
Resolution 2.20 Å R-free 0.251 |
| 6RWP Engineered beta-lactoglobulin: variant L58F in complex with myristic acid Deposited 2019-06-05 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, L58F | MYR MYRISTIC ACID × 1 SO4 SULFATE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；2.80 M (NH4)2SO4 in 0.1 M Tris-HCl pH 8.0, 5 mM myristic acid
|
Resolution 2.10 Å R-free 0.245 |
| 6RWQ Engineered beta-lactoglobulin: variant F105L in complex with myristic acid Deposited 2019-06-05 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, F105L | MYR MYRISTIC ACID × 2 EDO 1,2-ETHANEDIOL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；3.00 M (NH4)2SO4 in 0.1 M Tris-HCl pH 8.0
|
Resolution 2.05 Å R-free 0.255 |
| 6RWR Engineered beta-lactoglobulin: variant M107L in complex with myristic acid Deposited 2019-06-05 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, M107L | MYR MYRISTIC ACID × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；1.34 M tri-sodium citrate, 0.1 M Tris pH 8.0
|
Resolution 2.10 Å R-free 0.221 |
| 6RYT Engineered beta-lactoglobulin: variant M107L Deposited 2019-06-11 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Chain B
17–178（162 aa）
|
Mutation：L1A, I2S, M107L Mutation：L1A, I2S, M107L | GOL GLYCEROL × 2 PO4 PHOSPHATE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；2.60 M (NH4)2SO4 in 0.1 Tris-HCl pH 7.9
|
Resolution 2.10 Å R-free 0.278 |
| 6T42 Bovine lactoglobulin complex with decanol Deposited 2019-10-11 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Not recorded | DE1 DECAN-1-OL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；293 K；1.34 M sodium citrate in 0.1 M Tris-HCl pH 7.5, decanol
|
Resolution 1.95 Å R-free 0.229 |
| 6XVE Engineered beta-lactoglobulin: variant F105L Deposited 2020-01-21 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
|
Mutation：L1A, I2S, F105L | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；3.00 M (NH4)2SO4 IN 0.1 M TRIS-HCL PH 8.0
|
Resolution 2.15 Å R-free 0.291 |
| 6ZSQ Crystal structure of the Cisplatin beta-Lactoglobulin adduct formed after 18 h of soaking Deposited 2020-07-16 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain AAA
17–178（162 aa）
|
Not recorded | NH3 AMMONIA × 1 PT PLATINUM (II) ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 6.9；293 K；Crystals of beta-Lactoglobulin were grown using 3.0 M (NH4)2SO4, 0.1 M sodium/potassium phosphate buffer pH 6.9 as reservoir. Protein crystallizes at a concentration of 18 mg/mL. Crystals of beta-Lactoglobulin were soaked in a solution consisting of 3.0 M (NH4)2SO4, 0.1 M sodium/potassium phosphate buffer (pH 6.9) with 5 mM CDDP (about 1:3 protein to metal ratio).
|
Resolution 2.00 Å R-free 0.224 |
| 6ZSQ Crystal structure of the Cisplatin beta-Lactoglobulin adduct formed after 18 h of soaking Deposited 2020-07-16 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain BBB
17–178（162 aa）
|
Not recorded | PT PLATINUM (II) ION × 2 SO4 SULFATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 6.9；293 K；Crystals of beta-Lactoglobulin were grown using 3.0 M (NH4)2SO4, 0.1 M sodium/potassium phosphate buffer pH 6.9 as reservoir. Protein crystallizes at a concentration of 18 mg/mL. Crystals of beta-Lactoglobulin were soaked in a solution consisting of 3.0 M (NH4)2SO4, 0.1 M sodium/potassium phosphate buffer (pH 6.9) with 5 mM CDDP (about 1:3 protein to metal ratio).
|
Resolution 2.00 Å R-free 0.224 |
| 6ZSR Crystal structure of the Cisplatin beta-Lactoglobulin adduct formed after 72 h of soaking Deposited 2020-07-16 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain AAA
17–178（162 aa）
|
Not recorded | NH3 AMMONIA × 1 PT PLATINUM (II) ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 6.9；293 K；Crystals of beta-Lactoglobulin were grown using 3.0 M (NH4)2SO4, 0.1 M sodium/potassium phosphate buffer pH 6.9 as reservoir. Protein crystallizes at a concentration of 18 mg/mL. Crystals of beta-Lactoglobulin were soaked in a solution consisting of 3.0 M (NH4)2SO4, 0.1 M sodium/potassium phosphate buffer (pH 6.9) with 5 mM CDDP (about 1:3 protein to metal ratio).
|
Resolution 2.00 Å R-free 0.283 |
| 6ZSR Crystal structure of the Cisplatin beta-Lactoglobulin adduct formed after 72 h of soaking Deposited 2020-07-16 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain BBB
17–178（162 aa）
|
Not recorded | NH3 AMMONIA × 1 PT PLATINUM (II) ION × 3 SO4 SULFATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 6.9；293 K；Crystals of beta-Lactoglobulin were grown using 3.0 M (NH4)2SO4, 0.1 M sodium/potassium phosphate buffer pH 6.9 as reservoir. Protein crystallizes at a concentration of 18 mg/mL. Crystals of beta-Lactoglobulin were soaked in a solution consisting of 3.0 M (NH4)2SO4, 0.1 M sodium/potassium phosphate buffer (pH 6.9) with 5 mM CDDP (about 1:3 protein to metal ratio).
|
Resolution 2.00 Å R-free 0.283 |
| 7BF7 Mutant L58F of recombinant bovine beta-lactoglobulin in complex with tetracaine Deposited 2021-01-01 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, L58F | TE4 Tetracaine × 2 SO4 SULFATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；2.8 M ammonium sulfate in 0.5 M Tris-HCl pH 8.0
|
Resolution 2.10 Å R-free 0.249 |
| 7BF8 Mutant I56F of recombinant bovine beta-lactoglobulin in complex with tetracaine Deposited 2021-01-01 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
Chain BBB
17–178（162 aa）
|
Mutation：L1A, I2S, I56F Mutation：L1A, I2S, I56F | SO4 SULFATE ION × 3 TE4 Tetracaine × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；2.4 M ammonium sulfate in 0.5 M Tris-HCl pH 8.0
|
Resolution 1.80 Å R-free 0.222 |
| 7BF9 Mutant M107L of recombinant bovine beta-lactoglobulin in complex with tetracaine Deposited 2021-01-01 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, M107L | TE4 Tetracaine × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；1,34 M tri-sodium citrate in 0.5 Tris o pH 8.0
|
Resolution 1.80 Å R-free 0.223 |
| 7BGA Mutant F105A of recombinant beta-lactoglobulin in complex with endogenous ligand Deposited 2021-01-06 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, F105A | DAO LAURIC ACID × 2 SO4 SULFATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.6 M ammonium sulfate in 0.5 M Tris-HCl pH 8.5
|
Resolution 1.90 Å R-free 0.243 |
| 7BGX Mutant F105L of recombinant beta-lactoglobulin Deposited 2021-01-08 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, F105L | GOL GLYCEROL × 4 SO4 SULFATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；293 K；2.4 M ammonium sulfate in 0.5 M Tris-HCl pH 8.0
|
Resolution 2.00 Å R-free 0.246 |
| 7BGZ Mutant L39K of recombinant beta-lactoglobulin in complex with endogenous ligand Deposited 2021-01-09 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, L39K | DKA DECANOIC ACID × 2 EDO 1,2-ETHANEDIOL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；3.0 M ammonium sulfate in 0.5 M Tris-HCl pH 8.5
|
Resolution 2.40 Å R-free 0.266 |
| 7BH0 Mutant L39Y of recombinant beta-lactoglobulin in complex with endogenous ligand Deposited 2021-01-09 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, L39Y | DAO LAURIC ACID × 2 CL CHLORIDE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.1；293 K；2.2 M ammonium sulfate in 0.5 M Tris-HCl pH 7.1
|
Resolution 2.10 Å R-free 0.275 |
| 7KOT Energetic and structural effects of the Tanford transition on the ligand recognition of bovine Beta-lactoglobulin Deposited 2020-11-09 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
17–178（162 aa）
|
Not recorded | SDS DODECYL SULFATE × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8；277.15 K；0.1 M NaCl, pH 4.5 and in 0.05 M Tris-HCl, 0.1 M NaCl, pH 8.0
|
Resolution 1.74 Å R-free 0.229 |
| 7KP5 Energetic and structural effects of the Tanford transition on the ligand recognition of bovine Beta-lactoglobulin Deposited 2020-11-10 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AA1
17–178（162 aa）
Chain BA1
17–178（162 aa）
|
Not recorded | SDS DODECYL SULFATE × 3 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 4.5；277.15 K；12-15 mg/mL protein in 0.05M acetate and 0.1 M NaCl. Combined 1:1 with 0.05M KH2PO4, 20% PEG
|
Resolution 2.40 Å R-free 0.269 |
| 7NQB X.ray structure of the oxaliplatin/beta-lactoglobulin adduct Deposited 2021-03-01 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain AAA
17–178（162 aa）
|
Not recorded | PT PLATINUM (II) ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；0.2M KCl, 0.04M HEPES, 35% v/v pentaerythritol propoxylate
|
Resolution 2.01 Å R-free 0.284 |
| 7NQB X.ray structure of the oxaliplatin/beta-lactoglobulin adduct Deposited 2021-03-01 | Different construct Different mutation/modification Different oligomeric state Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 2 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain BBB
17–178（162 aa）
|
Not recorded | No recorded non-water small molecule |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 7.5；293 K；0.2M KCl, 0.04M HEPES, 35% v/v pentaerythritol propoxylate
|
Resolution 2.01 Å R-free 0.284 |
| 7Q17 Beta-lactoglobulin mutant FAW (I56F/L39A/M107W), unliganded form Deposited 2021-10-18 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, L39A, I56F, M107W | EDO 1,2-ETHANEDIOL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.40 M ammonium sulfate, 0.5 M Tris-HCl pH 8.5
|
Resolution 1.80 Å R-free 0.226 |
| 7Q18 Beta-lactoglobulin mutant FAF (I56F/L39A/M107F), unliganded form Deposited 2021-10-18 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
Chain BBB
17–178（162 aa）
|
Mutation：L1A, I2S, L39A, I56F, M107F Mutation：L1A, I2S, L39A, I56F, M107F | SO4 SULFATE ION × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.40 M (NH4)2SO4, 0.5 M Tris-HCl pH 8.5
|
Resolution 1.80 Å R-free 0.233 |
| 7Q19 Beta-lactoglobulin mutant FAW (I56F/L39A/M107W) in complex with desipramine (FAW-DSM#3) Deposited 2021-10-18 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, L39A, I56F, M107W | DSM 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE × 2 EDO 1,2-ETHANEDIOL × 2 SO4 SULFATE ION × 4 CL CHLORIDE ION × 6 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.40 M (NH4)2SO4, 0.5 M Tris-HCl pH 8.5, desipramine
|
Resolution 1.55 Å R-free 0.234 |
| 7Q2N Beta-lactoglobulin mutant FAF (I56F/L39A/M107F) in complex with desipramine (FAF-DSM) Deposited 2021-10-25 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
Chain BBB
17–178（162 aa）
|
Mutation：L1A, I2S, L39A, I56F, M107F Mutation：L1A, I2S, L39A, I56F, M107F | DSM 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE × 4 GOL GLYCEROL × 1 CL CHLORIDE ION × 1 EDO 1,2-ETHANEDIOL × 1 SO4 SULFATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.40 M (NH4)2SO4, 0.5 M Tris-HCl pH 8.5, desipramine
|
Resolution 1.70 Å R-free 0.233 |
| 7Q2O Beta-lactoglobulin mutant FAW (I56F/L39A/M107W) in complex with desipramine (FAW-DSM#1) Deposited 2021-10-25 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
Chain BBB
17–178（162 aa）
|
Mutation：L1A, I2S, L39A, I56F, M107W Mutation：L1A, I2S, L39A, I56F, M107W | SO4 SULFATE ION × 1 DSM 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE × 4 CL CHLORIDE ION × 1 EDO 1,2-ETHANEDIOL × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.20 M (NH4)2SO4, 0.5 M Tris-HCl pH 8.5
|
Resolution 1.80 Å R-free 0.221 |
| 7Q2P Beta-lactoglobulin mutant FAW (I56F/L39A/M107W) in complex with desipramine (FAW-DSM#2) Deposited 2021-10-25 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
Chain BBB
17–178（162 aa）
|
Mutation：L1A, I2S, L39A, I56F, M107W Mutation：L1A, I2S, L39A, I56F, M107W | EDO 1,2-ETHANEDIOL × 2 DSM 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE × 3 SO4 SULFATE ION × 2 CL CHLORIDE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.40 M (NH4)2SO4, 0.5 M Tris-HCl pH 8.5
|
Resolution 1.69 Å R-free 0.235 |
| 7WQL Bovin Beta-lactoglobulin binding with zinc ions Deposited 2022-01-25 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain A
17–178（162 aa）
Chain B
17–178（162 aa）
|
Not recorded | ZN ZINC ION × 6 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；293.15 K；20% PEG3350, 200 mM Ammonium formate
|
Resolution 2.00 Å R-free 0.261 |
| 7Z9Z Mutant L39Y of recombinant bovine beta-lactoglobulin in complex with pramocaine Deposited 2022-03-21 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
19–178（160 aa）
|
Mutation：L1A, I2S, L39Y | PX9 Pramocaine × 2 SO4 SULFATE ION × 2 CL CHLORIDE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.4 M ammonium sulfate in 0.5 M Tris-HCl, pH 8.5
|
Resolution 2.50 Å R-free 0.276 |
| 7ZA0 Mutant L58F of recombinant bovine beta-lactoglobulin in complex with pramocaine Deposited 2022-03-21 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
17–178（162 aa）
|
Mutation：L1A, I2S, L58F | PX9 Pramocaine × 2 SO4 SULFATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.2 M ammonium sulfate in 0.5 M Tris-HCl pH 8.5
|
Resolution 2.10 Å R-free 0.224 |
| 7ZCD Mutant L39Y-L58F of recombinant bovine beta-lactoglobulin in complex with pramocaine Deposited 2022-03-27 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
19–178（160 aa）
|
Mutation：L1A, I2S, L39Y, L58F | PX9 Pramocaine × 2 SO4 SULFATE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.2M ammonium sulfate, 0.5 M Tris-HCl, pH 8.5
|
Resolution 2.10 Å R-free 0.269 |
| 7ZLF Mutant L39Y-L58F of recombinant bovine beta-lactoglobulin in complex with endogenous fatty acid Deposited 2022-04-14 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 2 PDB declaration: dimeric |
Chain AAA
19–178（160 aa）
|
Mutation：L1A, I2S, L39Y, L58F | DAO LAURIC ACID × 2 EDO 1,2-ETHANEDIOL × 4 SO4 SULFATE ION × 2 CL CHLORIDE ION × 2 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP；pH 8.5；293 K；2.4 M in 0.5 M Tris-HCl, pH 8.5
|
Resolution 2.10 Å R-free 0.237 |
| 9I7N Beta-lactoglobulin complex with retinol post lyophilization Deposited 2025-01-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
1–178（178 aa）
|
Not recorded | RTL RETINOL × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 7.4；293 K；2.4 M ammonium sulfate
0.5 M TRIS
|
Resolution 1.95 Å R-free 0.211 |
| 9I7O Beta-lactoglobulin complex with retinol Deposited 2025-01-31 | Different construct Different mutation/modification Different oligomeric state Different ligand/ion Different experimental method Different experimental conditions Different structure-quality metrics | Assembly 1 Protein monomer Monomer；Protein × 1 PDB declaration: monomeric |
Chain A
1–178（178 aa）
|
Not recorded | RTL RETINOL × 1 |
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP；pH 7.4；293 K；2.4 M ammonium sulfate
0.5 M TRIS
|
Resolution 2.00 Å R-free 0.197 |
| 9IAH Structure of beta-lactoglobulin fibril Deposited 2025-02-10 | Different construct Different mutation/modification Different oligomeric state Different experimental conditions Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 5 PDB declaration: pentameric |
Chain A
17–50（34 aa）
Chain B
17–50（34 aa）
Chain C
17–50（34 aa）
Chain D
17–50（34 aa）
Chain E
17–50（34 aa）
|
Not recorded | No recorded non-water small molecule |
ELECTRON MICROSCOPY
cryo-EM buffer
pH 2.5
cryo-EM vitrification conditions
Cryogen ETHANE-PROPANE；3.7 ul sample was applied and blotted for 6 s after a wait time of 30 s with a force of 0
|
Resolution 3.17 Å |
| 9JHF Cryo-EM structure of beta-LG fibril Deposited 2024-09-09 | Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 6 PDB declaration: hexameric |
Chain AA
17–48（32 aa）
Chain AB
17–48（32 aa）
Chain AC
17–48（32 aa）
Chain AD
17–48（32 aa）
Chain AE
17–48（32 aa）
Chain AF
17–48（32 aa）
|
Not recorded | No recorded non-water small molecule |
ELECTRON MICROSCOPY
cryo-EM buffer
pH 2
cryo-EM vitrification conditions
Cryogen ETHANE
|
Resolution 4.06 Å |
| 9JHG Cryo-em structure of beta-LG fibril Deposited 2024-09-09 | Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 6 PDB declaration: hexameric |
Chain A
17–48（32 aa）
Chain B
17–48（32 aa）
Chain C
17–48（32 aa）
Chain D
17–48（32 aa）
Chain E
17–48（32 aa）
Chain F
17–48（32 aa）
|
Not recorded | No recorded non-water small molecule |
ELECTRON MICROSCOPY
cryo-EM buffer
pH 2
cryo-EM vitrification conditions
Cryogen ETHANE
|
Resolution 3.38 Å |
| 9JHH Cryo-em structure of beta-LG fibril Deposited 2024-09-09 | Different structure-quality metrics | Assembly 1 Protein homooligomer Homooligomer；Protein × 6 PDB declaration: hexameric |
Chain A
17–48（32 aa）
Chain B
17–48（32 aa）
Chain C
17–48（32 aa）
Chain D
17–48（32 aa）
Chain E
17–48（32 aa）
Chain F
17–48（32 aa）
|
Not recorded | No recorded non-water small molecule |
ELECTRON MICROSCOPY
cryo-EM buffer
pH 2
cryo-EM vitrification conditions
Cryogen ETHANE
|
Resolution 3.45 Å |
101 other PDB entries and 123 assemblies. Open the comparison page and filter oligomeric states
View Construct and Data Evidence
| UniProt name | LACB_BOVIN |
| Isoform | — |
| PDB entities | 1 |
| Chains and sequence ranges | Author chain AA； PDBConstruct 1–32； UniProt 17–48 Author chain AB； PDBConstruct 1–32； UniProt 17–48 Author chain AC； PDBConstruct 1–32； UniProt 17–48 Author chain AD； PDBConstruct 1–32； UniProt 17–48 Author chain AE； PDBConstruct 1–32； UniProt 17–48 Author chain AF； PDBConstruct 1–32； UniProt 17–48 |
