|
1KIL
Three-dimensional structure of the complexin/SNARE complex
Deposited 2001-12-03
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain C
10–81(72 aa)
Fragment:SNARE motif (11-82)
Chain D
139–204(66 aa)
Fragment:SNARE motif (141-203)
|
Mutation:W added at C-terminus
Mutation:W added at C-terminus
|
MG MAGNESIUM ION × 2
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;pH 7.5;277 K;27%(v/v) Iso-Propanol, 200mM MgCl2, 100mM Hepes, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K
|
Resolution 2.30 Å
R-free 0.305
|
|
1XTG
Crystal structure of NEUROTOXIN BONT/A complexed with Synaptosomal-associated protein 25
Deposited 2004-10-21
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 2
PDB declaration: dimeric
|
Chain B
146–204(59 aa)
Fragment:n2 domain
|
Not recorded
|
ZN ZINC ION × 1
CL CHLORIDE ION × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;pH 6.5;277 K;10% PEG 8000, 200 mM magnesium acetate, 100 mM sodium cacodylate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature
4K
|
Resolution 2.10 Å
R-free 0.247
|
|
2N1T
Dynamic binding mode of a synaptotagmin-1-SNARE complex in solution
Deposited 2015-04-21
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental method
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain C
7–83(77 aa)
Fragment:N-terminal domain (UNP residues 7-83)
Chain D
131–204(74 aa)
Fragment:C-terminal domain (UNP residues 131-204)
|
Not recorded
|
No recorded non-water small molecule
|
SOLUTION NMR
NMR measurement conditions
pH 7.4;298 K;Pressure ambient
NMR sample composition
30 uM [U-100% 13C; U-100% 15N] protein, 25 mM Tris-HCl, 125 mM KSCN, 1 mM CaCl2, 90% H2O/10% D2O | 90% H2O/10% D2O
|
Resolution not provided
|
|
3DDA
Crystal structure of the catalytic domain of Botulinum neurotoxin serotype a with a snap-25 peptide
Deposited 2008-06-05
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 2
PDB declaration: dimeric
|
Chain B
197–202(6 aa)
Fragment:sequence database residues 197-202
|
Non-standard monomer:Yes (specific site not provided by mmCIF)
|
ZN ZINC ION × 1
SO4 SULFATE ION × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 6.5;293 K;20% PEG8000, 0.2M Ammoium Sulfate, 0.1M Sodium Cacodylate, 5% Ethylene Glycol, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K
|
Resolution 1.50 Å
R-free 0.200
|
|
3RK2
Truncated SNARE complex
Deposited 2011-04-17
|
Different construct
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 4
PDB declaration: tetrameric
|
Chain C
7–82(76 aa)
Fragment:UNP residues 7-82
Chain D
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
CA CALCIUM ION × 4
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6.5;294 K;0.05 M calcium acetate, 27% 2-methyl-2,4-pentanediol (MPD), 0.1 M sodium cacodylate pH 6.5-7.0, VAPOR DIFFUSION, temperature 294K
|
Resolution 2.20 Å
R-free 0.268
|
|
3RK2
Truncated SNARE complex
Deposited 2011-04-17
|
Different construct
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 2
Protein heterocomplex
Heteromer;Protein × 4
PDB declaration: tetrameric
|
Chain G
7–82(76 aa)
Fragment:UNP residues 7-82
Chain H
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6.5;294 K;0.05 M calcium acetate, 27% 2-methyl-2,4-pentanediol (MPD), 0.1 M sodium cacodylate pH 6.5-7.0, VAPOR DIFFUSION, temperature 294K
|
Resolution 2.20 Å
R-free 0.268
|
|
3RK3
Truncated SNARE complex with complexin
Deposited 2011-04-17
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain C
7–82(76 aa)
Fragment:UNP residues 7-82
Chain D
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.50 Å
R-free 0.316
|
|
3RL0
Truncated SNARE complex with complexin (P1)
Deposited 2011-04-19
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain C
7–82(76 aa)
Fragment:UNP residues 7-82
Chain D
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, and 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.80 Å
R-free 0.345
|
|
3RL0
Truncated SNARE complex with complexin (P1)
Deposited 2011-04-19
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 2
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain G
7–82(76 aa)
Fragment:UNP residues 7-82
Chain H
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, and 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.80 Å
R-free 0.345
|
|
3RL0
Truncated SNARE complex with complexin (P1)
Deposited 2011-04-19
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 3
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain K
7–82(76 aa)
Fragment:UNP residues 7-82
Chain L
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, and 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.80 Å
R-free 0.345
|
|
3RL0
Truncated SNARE complex with complexin (P1)
Deposited 2011-04-19
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 4
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain O
7–82(76 aa)
Fragment:UNP residues 7-82
Chain P
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, and 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.80 Å
R-free 0.345
|
|
3RL0
Truncated SNARE complex with complexin (P1)
Deposited 2011-04-19
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 5
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain S
7–82(76 aa)
Fragment:UNP residues 7-82
Chain T
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, and 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.80 Å
R-free 0.345
|
|
3RL0
Truncated SNARE complex with complexin (P1)
Deposited 2011-04-19
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 6
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain W
7–82(76 aa)
Fragment:UNP residues 7-82
Chain X
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, and 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.80 Å
R-free 0.345
|
|
3RL0
Truncated SNARE complex with complexin (P1)
Deposited 2011-04-19
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 7
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain a
7–82(76 aa)
Fragment:UNP residues 7-82
Chain b
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, and 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.80 Å
R-free 0.345
|
|
3RL0
Truncated SNARE complex with complexin (P1)
Deposited 2011-04-19
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 8
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain e
7–82(76 aa)
Fragment:UNP residues 7-82
Chain f
141–203(63 aa)
Fragment:UNP residues 141-203
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 7.5;294 K;13-15% polyethyleneglycol (PEG) 5000MME, 0.2 M ammonium sulfate, 0.01 M EDTA, and 0.1 M Tris pH 7.5, VAPOR DIFFUSION, temperature 294K
|
Resolution 3.80 Å
R-free 0.345
|
|
3ZUR
Crystal structure of an engineered botulinum neurotoxin type A- SNARE23 derivative, LC0-A-SNAP25-Hn-A
Deposited 2011-07-19
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Insufficient information
Monomer;Protein × 1
PDB declaration: monomeric
|
Chain A
145–206(62 aa)
Fragment:CATALYTIC DOMAIN, RESIDUES 3-431, SNAP25, RESIDUES 145-206, TRANSLOCATION DOMAIN RESIDUES, 454-865
|
Mutation:YES
|
SO4 SULFATE ION × 4
|
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.5;0.1 M TRIS PH 7.5, 0.2 M LISO4, 15% PEG 3350.
|
Resolution 2.71 Å
R-free 0.266
|
|
3ZUR
Crystal structure of an engineered botulinum neurotoxin type A- SNARE23 derivative, LC0-A-SNAP25-Hn-A
Deposited 2011-07-19
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 2
Insufficient information
Monomer;Protein × 1
PDB declaration: monomeric
|
Chain B
145–206(62 aa)
Fragment:CATALYTIC DOMAIN, RESIDUES 3-431, SNAP25, RESIDUES 145-206, TRANSLOCATION DOMAIN RESIDUES, 454-865
|
Mutation:YES
|
SO4 SULFATE ION × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.5;0.1 M TRIS PH 7.5, 0.2 M LISO4, 15% PEG 3350.
|
Resolution 2.71 Å
R-free 0.266
|
|
8BAN
Secretagogin (mouse) in complex with its target peptide from SNAP-25
Deposited 2022-10-11
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Insufficient information
Heteromer;Protein × 2
PDB declaration: dimeric
|
Chain A
155–179(25 aa)
|
Mutation:F64L,Q80R,I167T MUTATIONS IN ENHANCED GFP (HIGHER FLUORESCENCE INTENSITY)
Non-standard monomer:Yes (specific site not provided by mmCIF)
|
CA CALCIUM ION × 4
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6.5;277 K;PEG 3350 (20%), 2 mM CaCl2, 0.1 M Bis-Tris-Propane pH 6.5, 25 mM Tris-HCl pH 8.0, 0.2 M NaI
|
Resolution 2.35 Å
R-free 0.248
|
|
8BAN
Secretagogin (mouse) in complex with its target peptide from SNAP-25
Deposited 2022-10-11
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 2
Insufficient information
Heteromer;Protein × 2
PDB declaration: dimeric
|
Chain B
155–179(25 aa)
|
Mutation:F64L,Q80R,I167T MUTATIONS IN ENHANCED GFP (HIGHER FLUORESCENCE INTENSITY)
Non-standard monomer:Yes (specific site not provided by mmCIF)
|
CA CALCIUM ION × 4
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6.5;277 K;PEG 3350 (20%), 2 mM CaCl2, 0.1 M Bis-Tris-Propane pH 6.5, 25 mM Tris-HCl pH 8.0, 0.2 M NaI
|
Resolution 2.35 Å
R-free 0.248
|
|
8BAV
Secretagogin (human) in complex with its target peptide from SNAP-25
Deposited 2022-10-12
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Insufficient information
Heteromer;Protein × 2
PDB declaration: dimeric
|
Chain A
155–179(25 aa)
|
Non-standard monomer:Yes (specific site not provided by mmCIF)
|
ACT ACETATE ION × 1
CA CALCIUM ION × 4
144 TRIS-HYDROXYMETHYL-METHYL-AMMONIUM × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8;277 K;0.2 M Na-acetate
20% PEG3350
|
Resolution 2.30 Å
R-free 0.262
|
|
8BAV
Secretagogin (human) in complex with its target peptide from SNAP-25
Deposited 2022-10-12
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 2
Insufficient information
Heteromer;Protein × 2
PDB declaration: dimeric
|
Chain B
155–179(25 aa)
|
Non-standard monomer:Yes (specific site not provided by mmCIF)
|
ACT ACETATE ION × 1
CA CALCIUM ION × 4
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8;277 K;0.2 M Na-acetate
20% PEG3350
|
Resolution 2.30 Å
R-free 0.262
|