|
11MM
The structure of human Vacuolar Protein Sorting 34 catalytic domain bound to RD-II-81
Deposited 2026-03-05
|
Different construct
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
290–871(582 aa)
|
Not recorded
|
GOL GLYCEROL × 2
A1C9V (8S)-3-[6-(propan-2-yl)-1,3-benzothiazol-2-yl]pyrazolo[1,5-a]pyrimidine × 1
DMS DIMETHYL SULFOXIDE × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6;298 K;BIS-TRIS pH 6.5,
20% w/v Polyethylene glycol monomethyl ether 5,000
|
Resolution 2.69 Å
R-free 0.265
|
|
11YC
The structure of human Vacuolar Protein Sorting 34 catalytic domain bound to RD-II-123
Deposited 2026-03-17
|
Different construct
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
290–871(582 aa)
|
Not recorded
|
A1DAY (8S)-3-(6-butyl-1,3-benzothiazol-2-yl)pyrazolo[1,5-a]pyrimidine × 1
EDO 1,2-ETHANEDIOL × 1
PEG DI(HYDROXYETHYL)ETHER × 1
CL CHLORIDE ION × 4
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6;298 K;Ammonium Acetate, HEPES, Polyethylene glycol 3,350
|
Resolution 2.41 Å
R-free 0.220
|
|
13BV
Cryo-EM structure of human PI3KC3-C1 complex
Deposited 2026-04-28
|
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 4
PDB declaration: tetrameric
|
Chain B
1–887(887 aa)
|
Not recorded
|
MYR MYRISTIC ACID × 1
GDP GUANOSINE-5'-DIPHOSPHATE × 1
MG MAGNESIUM ION × 1
|
ELECTRON MICROSCOPY
cryo-EM buffer
pH 7.5
cryo-EM vitrification conditions
Cryogen ETHANE
|
Resolution 3.77 Å
|
|
3IHY
Human PIK3C3 crystal structure
Deposited 2009-07-31
|
Different construct
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
282–879(598 aa)
Fragment:UNP residues 282-879
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8.5;277 K;0.2M ammonium acetate
25% PEG3350
0.1M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K
|
Resolution 2.80 Å
R-free 0.255
|
|
3IHY
Human PIK3C3 crystal structure
Deposited 2009-07-31
|
Different construct
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
282–879(598 aa)
Fragment:UNP residues 282-879
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8.5;277 K;0.2M ammonium acetate
25% PEG3350
0.1M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K
|
Resolution 2.80 Å
R-free 0.255
|
|
3IHY
Human PIK3C3 crystal structure
Deposited 2009-07-31
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental method
Different experimental conditions
Different structure-quality metrics
|
Assembly 3
Protein monomer
Monomer;Protein × 1
PDB declaration: monomeric
|
Chain C
282–879(598 aa)
Fragment:UNP residues 282-879
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8.5;277 K;0.2M ammonium acetate
25% PEG3350
0.1M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K
|
Resolution 2.80 Å
R-free 0.255
|
|
3IHY
Human PIK3C3 crystal structure
Deposited 2009-07-31
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental method
Different experimental conditions
Different structure-quality metrics
|
Assembly 4
Protein monomer
Monomer;Protein × 1
PDB declaration: monomeric
|
Chain D
282–879(598 aa)
Fragment:UNP residues 282-879
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8.5;277 K;0.2M ammonium acetate
25% PEG3350
0.1M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K
|
Resolution 2.80 Å
R-free 0.255
|
|
3IHY
Human PIK3C3 crystal structure
Deposited 2009-07-31
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental method
Different experimental conditions
Different structure-quality metrics
|
Assembly 5
Protein monomer
Monomer;Protein × 1
PDB declaration: monomeric
|
Chain E
282–879(598 aa)
Fragment:UNP residues 282-879
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8.5;277 K;0.2M ammonium acetate
25% PEG3350
0.1M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K
|
Resolution 2.80 Å
R-free 0.255
|
|
3LS8
Crystal structure of human PIK3C3 in complex with 3-[4-(4-Morpholinyl)thieno[3,2-d]pyrimidin-2-yl]-phenol
Deposited 2010-02-12
|
Different construct
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
268–879(612 aa)
Fragment:UNP Residues 268-879
|
Not recorded
|
AJZ 3-(4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl)phenol × 1
CL CHLORIDE ION × 2
GOL GLYCEROL × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 7.5;293 K;25% PEG3350, 0.2M ammonium acetate, 0.1M hepes pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K
|
Resolution 2.25 Å
R-free 0.251
|
|
3LS8
Crystal structure of human PIK3C3 in complex with 3-[4-(4-Morpholinyl)thieno[3,2-d]pyrimidin-2-yl]-phenol
Deposited 2010-02-12
|
Different construct
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
268–879(612 aa)
Fragment:UNP Residues 268-879
|
Not recorded
|
AJZ 3-(4-morpholin-4-ylthieno[3,2-d]pyrimidin-2-yl)phenol × 1
CL CHLORIDE ION × 2
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 7.5;293 K;25% PEG3350, 0.2M ammonium acetate, 0.1M hepes pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K
|
Resolution 2.25 Å
R-free 0.251
|
|
4OYS
CRYSTAL STRUCTURE OF VPS34 IN COMPLEX WITH SAR405.
Deposited 2014-02-13
|
Different construct
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
282–879(598 aa)
Fragment:UNP residues 282-879
|
Not recorded
|
SO4 SULFATE ION × 4
1TT (8S)-9-[(5-chloranylpyridin-3-yl)methyl]-2-[(3R)-3-methylmorpholin-4-yl]-8-(trifluoromethyl)-6,7,8,9a-tetrahydro-3H-pyrimido[1,2-a]pyrimidin-4-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;pH 7.5;293 K;1.9 M ammonium sulfate, 100 mM Tris pH 8.5
|
Resolution 2.90 Å
R-free 0.248
|
|
4PH4
The crystal structure of Human VPS34 in complex with PIK-III
Deposited 2014-05-04
|
Different construct
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
293–887(595 aa)
Fragment:UNP residues 293-887
|
Not recorded
|
GOL GLYCEROL × 1
2UG 4'-(cyclopropylmethyl)-N~2~-(pyridin-4-yl)-4,5'-bipyrimidine-2,2'-diamine × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;303.15 K;VPS34 protein and PIK-III were mixed and incubated on ice for 1 hr (final PIK-III concentration was 1 mM). Prior to crystallization, the mixture was passed through a 0.2 um filter. The protein:ligand complex was crystallized using the hanging drop vapor diffusion method in Nextal plates: 6 uL of protein solution was mixed with 4 uL of precipitant, which consisted of 20% (w/v) PEG 3350, 100 mM bis-tris propane, and 200 mM Na-K-phosphate. The resulting drop was suspended over a reservoir of 0.3 mL of precipitant and sealed with a screw cap. The crystals grew at 30 degC in approximately 12-24 hr.
|
Resolution 2.80 Å
R-free 0.223
|
|
4UWF
Discovery of (2S)-8-((3R)-3-Methylmorpholin-4-yl)-1-(3-methyl-2-oxo- butyl)-2-(trifluoromethyl)-3,4-dihydro-2H-pyrimido(1,2-a)pyrimidin-6- one: a Novel Potent and Selective Inhibitor of Vps34 for the Treatment of Solid Tumors
Deposited 2014-08-12
|
Different construct
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
282–879(598 aa)
Fragment:VPS34 HELICAL AND KINASE DOMAINS, RESIDUES 282-879
|
Not recorded
|
EUT (8S)-9-[3,5-bis(fluoranyl)phenyl]-2-morpholin-4-yl-8-(trifluoromethyl)-7,8-dihydro-6H-pyrimido[1,2-a]pyrimidin-4-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 8;292 K;NA-MALONATE 1.4M, TRIS 100MM PH 8 AT 19C
|
Resolution 2.99 Å
R-free 0.246
|
|
4UWG
Discovery of (2S)-8-((3R)-3-Methylmorpholin-4-yl)-1-(3-methyl-2-oxo- butyl)-2-(trifluoromethyl)-3,4-dihydro-2H-pyrimido(1,2-a)pyrimidin-6- one: a Novel Potent and Selective Inhibitor of Vps34 for the Treatment of Solid Tumors
Deposited 2014-08-12
|
Different construct
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
282–879(598 aa)
Fragment:VPS34 HELICAL AND KINASE DOMAINS, RESIDUES 282-879
|
Not recorded
|
SO4 SULFATE ION × 3
RBQ (8S)-2-(morpholin-4-yl)-9-[2-(propan-2-yloxy)ethyl]-8-(trifluoromethyl)-6,7,8,9-tetrahydro-4H-pyrimido[1,2-a]pyrimidin-4-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 8.5;AMMONIUM SULFATE 2M - TRIS 100MM PH 8.5
|
Resolution 2.70 Å
R-free 0.221
|
|
4UWH
Discovery of (2S)-8-((3R)-3-Methylmorpholin-4-yl)-1-(3-methyl-2-oxo- butyl)-2-(trifluoromethyl)-3,4-dihydro-2H-pyrimido(1,2-a)pyrimidin-6- one: a Novel Potent and Selective Inhibitor of Vps34 for the Treatment of Solid Tumors
Deposited 2014-08-12
|
Different construct
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
282–879(598 aa)
Fragment:VPS34 HELICAL AND KINASE DOMAINS, RESIDUES 282-879
|
Not recorded
|
NA SODIUM ION × 2
JXM (8S)-9-[(2R)-2-hydroxy-2-phenylethyl]-2-(morpholin-4-yl)-8-(trifluoromethyl)-6,7,8,9-tetrahydro-4H-pyrimido[1,2-a]pyrimidin-4-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.5;NA CITRATE 1M PH8.0, pH 7.5
|
Resolution 1.93 Å
R-free 0.208
|
|
4UWK
Discovery of (2S)-8-((3R)-3-Methylmorpholin-4-yl)-1-(3-methyl-2-oxo- butyl)-2-(trifluoromethyl)-3,4-dihydro-2H-pyrimido(1,2-a)pyrimidin-6- one: a Novel Potent and Selective Inhibitor of Vps34 for the Treatment of Solid Tumors
Deposited 2014-08-12
|
Different construct
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
282–879(598 aa)
Fragment:VPS34 HELICAL AND KINASE DOMAINS, UNP RESIDUES 282-879
|
Not recorded
|
SO4 SULFATE ION × 1
GOL GLYCEROL × 1
UJB (2S)-1-[(5-chloro-2-thienyl)methyl]-8-[(3R,5R)-3,5-dimethylmorpholin-4-yl]-2-(trifluoromethyl)-3,4-dihydro-2H-pyrimido[1,2-a]pyrimidin-6-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 8.5;AMMONIUM SULFATE 1.8M - TRIS 100MM PH 8.5
|
Resolution 2.83 Å
R-free 0.225
|
|
4UWL
Discovery of (2S)-8-((3R)-3-Methylmorpholin-4-yl)-1-(3-methyl-2-oxo- butyl)-2-(trifluoromethyl)-3,4-dihydro-2H-pyrimido(1,2-a)pyrimidin-6- one: a Novel Potent and Selective Inhibitor of Vps34 for the Treatment of Solid Tumors
Deposited 2014-08-12
|
Different construct
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
282–879(598 aa)
Fragment:VPS34 HELICAL AND KINASE DOMAINS, RESIDUES 282-879
|
Not recorded
|
SO4 SULFATE ION × 2
7A5 (8S)-2-[(3R)-3-methylmorpholin-4-yl]-9-(3-methyl-2-oxobutyl)-8-(trifluoromethyl)-6,7,8,9-tetrahydro-4H-pyrimido[1,2-a]pyrimidin-4-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
pH 7.5;1.8M AMMONIUM SULFATE, 100MM TRIS PH 8
|
Resolution 2.80 Å
R-free 0.255
|
|
5ANL
Crystal structure of VPS34 in complex with (2S)-8-((3R)-3- Methylmorpholin-4-yl)-1-(3-methyl-2-oxo- butyl)-2-(trifluoromethyl)-3, 4-dihydro-2H-pyrimido(1,2-a)pyrimidin-6- one, processed with the CrystalDirect automated mounting and cryo-cooling technology
Deposited 2015-09-07
|
Different construct
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
282–879(598 aa)
Fragment:VPS34 HELICAL AND KINASE DOMAINS, UNP RESIDUES 282-879
|
Not recorded
|
RBQ (8S)-2-(morpholin-4-yl)-9-[2-(propan-2-yloxy)ethyl]-8-(trifluoromethyl)-6,7,8,9-tetrahydro-4H-pyrimido[1,2-a]pyrimidin-4-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
0.1 M TRIS, PH=7.5, 1.8 M AMMONIUM SULFATE
|
Resolution 2.70 Å
R-free 0.267
|
|
5ENN
The crystal structure of Human VPS34 in complex with a selective and potent inhibitor
Deposited 2015-11-09
|
Different construct
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
293–887(595 aa)
Fragment:UNP residues 293-887
|
Not recorded
|
5QS 1-[[4-(cyclopropylmethyl)-5-[2-(pyridin-4-ylamino)pyrimidin-4-yl]pyrimidin-2-yl]amino]-2-methyl-propan-2-ol × 1
NA SODIUM ION × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 7.5;291.15 K;200nL:200nL well to protein
0.2M Sodium Acetate
0.1M HEPES 7.5
20% PEG 3000
|
Resolution 2.70 Å
R-free 0.201
|
|
5ENN
The crystal structure of Human VPS34 in complex with a selective and potent inhibitor
Deposited 2015-11-09
|
Different construct
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
293–887(595 aa)
Fragment:UNP residues 293-887
|
Not recorded
|
5QS 1-[[4-(cyclopropylmethyl)-5-[2-(pyridin-4-ylamino)pyrimidin-4-yl]pyrimidin-2-yl]amino]-2-methyl-propan-2-ol × 1
NA SODIUM ION × 1
GOL GLYCEROL × 1
SO4 SULFATE ION × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 7.5;291.15 K;200nL:200nL well to protein
0.2M Sodium Acetate
0.1M HEPES 7.5
20% PEG 3000
|
Resolution 2.70 Å
R-free 0.201
|
|
6HOG
Structure of VPS34 LIR motif bound to GABARAP
Deposited 2018-09-17
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental method
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Insufficient information
Homooligomer;Protein × 3
PDB declaration: trimeric
|
Chain A
244–258(15 aa)
|
Not recorded
|
SO4 SULFATE ION × 6
EDO 1,2-ETHANEDIOL × 6
GOL GLYCEROL × 6
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;293 K;50 mM HEPES pH 7.1, 40% PEG 600
|
Resolution 1.26 Å
R-free 0.181
|
|
6HOH
Structure of VPS34 LIR motif (S249E) bound to GABARAP
Deposited 2018-09-17
|
Different construct
Different oligomeric state
Different ligand/ion
Different experimental method
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Insufficient information
Homooligomer;Protein × 3
PDB declaration: trimeric
|
Chain A
244–258(15 aa)
|
Not recorded
|
PGE TRIETHYLENE GLYCOL × 3
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;293 K;20% PEG 3350, 200 mM magnesium formate
|
Resolution 2.25 Å
R-free 0.250
|
|
6HOH
Structure of VPS34 LIR motif (S249E) bound to GABARAP
Deposited 2018-09-17
|
Different construct
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental method
Different experimental conditions
Different structure-quality metrics
|
Assembly 2
Insufficient information
Homooligomer;Protein × 3
PDB declaration: trimeric
|
Chain B
244–258(15 aa)
Chain C
244–258(15 aa)
Chain D
244–258(15 aa)
|
Not recorded
|
No recorded non-water small molecule
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;293 K;20% PEG 3350, 200 mM magnesium formate
|
Resolution 2.25 Å
R-free 0.250
|
|
6I3U
Optimization of potent and selective ATM inhibitors suitable for a proof-of-concept study in Huntington's disease models
Deposited 2018-11-07
|
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
268–879(612 aa)
|
Mutation:F612A, L616N, I634L, M682L, F684W, Q686_S687insG
|
H2E 2-morpholin-4-yl-6-[7-[(2~{R})-1-morpholin-4-ylpropan-2-yl]oxy-9~{H}-thioxanthen-4-yl]pyran-4-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;pH 7;293 K;1.4 M Sodium Malonate pH 7.0, 0.1 M Bis-Tris Propane pH 7.0
|
Resolution 2.09 Å
R-free 0.236
|
|
6YKG
Structure-based exploration of selectivity for ATM inhibitors in Huntingtons disease
Deposited 2020-04-06
|
Different construct
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
268–879(612 aa)
|
Not recorded
|
OZ8 4-morpholin-4-yl-6-[(2~{R})-2-(phenylmethyl)pyrrolidin-1-yl]-1~{H}-pyridin-2-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;pH 7;293 K;1.4 M sodium malonate pH 7.0, 0.1 M BIS-TRIS
|
Resolution 3.12 Å
R-free 0.261
|
|
7BL1
human complex II-BATS bound to membrane-attached Rab5a-GTP
Deposited 2021-01-17
|
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 6
PDB declaration: hexameric
|
Chain BBB
1–887(887 aa)
|
Not recorded
|
GTP GUANOSINE-5'-TRIPHOSPHATE × 1
MG MAGNESIUM ION × 1
|
ELECTRON MICROSCOPY
cryo-EM buffer
pH 8
cryo-EM vitrification conditions
Cryogen ETHANE;Blot force 20, blot time 6 s
|
Resolution 9.80 Å
|
|
7RSJ
Structure of the VPS34 kinase domain with compound 14
Deposited 2021-08-11
|
Different construct
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
282–879(598 aa)
|
Not recorded
|
NA SODIUM ION × 3
7IH N-{4-[(7R,8R)-4-oxo-7-(propan-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl]pyridin-2-yl}cyclopropanecarboxamide × 1
EDO 1,2-ETHANEDIOL × 1
GOL GLYCEROL × 2
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;277.15 K;0.2M Potassium/Sodium tartrate
0.1M Bis-Tris propane pH7.5,
20% PEG3350
0.7% v/v 1-butanol
|
Resolution 1.88 Å
R-free 0.203
|
|
7RSP
Structure of the VPS34 kinase domain with compound 14
Deposited 2021-08-11
|
Different construct
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
282–879(598 aa)
|
Not recorded
|
GOL GLYCEROL × 1
7IK (7R,8R)-2-[(3R)-3-methylmorpholin-4-yl]-7-(propan-2-yl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;277.15 K;0.2M Potassium/Sodium tartrate, 0.1M Bis-Tris propane pH7.5, 20% PEG3350
0.7% v/v 1-butanol
|
Resolution 1.67 Å
R-free 0.225
|
|
7RSP
Structure of the VPS34 kinase domain with compound 14
Deposited 2021-08-11
|
Different construct
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
282–879(598 aa)
|
Not recorded
|
GOL GLYCEROL × 2
7IK (7R,8R)-2-[(3R)-3-methylmorpholin-4-yl]-7-(propan-2-yl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;277.15 K;0.2M Potassium/Sodium tartrate, 0.1M Bis-Tris propane pH7.5, 20% PEG3350
0.7% v/v 1-butanol
|
Resolution 1.67 Å
R-free 0.225
|
|
7RSV
Structure of the VPS34 kinase domain with compound 5
Deposited 2021-08-11
|
Different construct
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
282–879(598 aa)
|
Not recorded
|
7IQ (5aS,8aR,9S)-2-[(3R)-3-methylmorpholin-4-yl]-5,5a,6,7,8,8a-hexahydro-4H-cyclopenta[e]pyrazolo[1,5-a]pyrazin-4-one × 1
GOL GLYCEROL × 2
NA SODIUM ION × 4
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;277.15 K;0.2M Potassium/Sodium tartrate
0.1M Bis-Tris propane pH7.5,
20% PEG3350
0.7% v/v 1-butanol
|
Resolution 1.78 Å
R-free 0.214
|
|
7RSV
Structure of the VPS34 kinase domain with compound 5
Deposited 2021-08-11
|
Different construct
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
282–879(598 aa)
|
Not recorded
|
7IQ (5aS,8aR,9S)-2-[(3R)-3-methylmorpholin-4-yl]-5,5a,6,7,8,8a-hexahydro-4H-cyclopenta[e]pyrazolo[1,5-a]pyrazin-4-one × 1
GOL GLYCEROL × 1
NA SODIUM ION × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, HANGING DROP;277.15 K;0.2M Potassium/Sodium tartrate
0.1M Bis-Tris propane pH7.5,
20% PEG3350
0.7% v/v 1-butanol
|
Resolution 1.78 Å
R-free 0.214
|
|
8RXR
Crystal structure of VPS34 in complex with inhibitor SB02024
Deposited 2024-02-07
|
Different construct
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
282–879(598 aa)
|
Not recorded
|
A1H4E 4-[(3R)-3-methylmorpholin-4-yl]-2-[(2R)-2-(trifluoromethyl)piperidin-1-yl]-3H-pyridin-6-one × 1
PEG DI(HYDROXYETHYL)ETHER × 2
IMD IMIDAZOLE × 1
DMS DIMETHYL SULFOXIDE × 3
GOL GLYCEROL × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8;277 K;22.5 % PEG3350, 0.2 M ammonium acetate, 0.1 M HEPES pH 8.0
|
Resolution 2.06 Å
R-free 0.225
|
|
8RXR
Crystal structure of VPS34 in complex with inhibitor SB02024
Deposited 2024-02-07
|
Different construct
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
282–879(598 aa)
|
Not recorded
|
A1H4E 4-[(3R)-3-methylmorpholin-4-yl]-2-[(2R)-2-(trifluoromethyl)piperidin-1-yl]-3H-pyridin-6-one × 1
DMS DIMETHYL SULFOXIDE × 5
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 8;277 K;22.5 % PEG3350, 0.2 M ammonium acetate, 0.1 M HEPES pH 8.0
|
Resolution 2.06 Å
R-free 0.225
|
|
9C82
Structure of human ULK1C:PI3KC3-C1 supercomplex
Deposited 2024-06-11
|
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain B
1–887(887 aa)
|
Not recorded
|
No recorded non-water small molecule
|
ELECTRON MICROSCOPY
cryo-EM buffer
pH 7.5
cryo-EM vitrification conditions
Cryogen ETHANE;added 0.05% (w/v) octylglucopyranoside as surfactant
|
Resolution 6.84 Å
|
|
9DKP
The structure of human vacuolar protein sorting 34 catalytic domain bound to RD-I-53
Deposited 2024-09-09
|
Different construct
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
290–871(582 aa)
|
Not recorded
|
A1A6F (8R)-3-(1,3-benzothiazol-2-yl)pyrazolo[1,5-a]pyrimidine × 1
ETX 2-ETHOXYETHANOL × 1
ETZ diethyl ether × 2
DMS DIMETHYL SULFOXIDE × 1
K POTASSIUM ION × 2
CL CHLORIDE ION × 13
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6;298 K;20% PEG, 0.2M MES pH 6.0
|
Resolution 2.16 Å
R-free 0.235
|
|
9E4V
The structure of human vacuolar protein sorting 34 catalytic domain bound to MES
Deposited 2024-10-25
|
Different construct
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
290–871(582 aa)
|
Not recorded
|
MES 2-(N-MORPHOLINO)-ETHANESULFONIC ACID × 1
PG4 TETRAETHYLENE GLYCOL × 1
DMS DIMETHYL SULFOXIDE × 1
PEG DI(HYDROXYETHYL)ETHER × 4
GOL GLYCEROL × 1
CL CHLORIDE ION × 4
K POTASSIUM ION × 3
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6;298 K;100mM MES, pH 6.0, 18% PEG3350
|
Resolution 2.36 Å
R-free 0.231
|
|
9MHG
Cryo EM reconstruction of PI3KC3-C1 in complex with Human RAB1A(Q70L), VPS34 kinase domain in the inactive conformation
Deposited 2024-12-11
|
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain B
1–887(887 aa)
|
Not recorded
|
GTP GUANOSINE-5'-TRIPHOSPHATE × 2
MG MAGNESIUM ION × 2
MYR MYRISTIC ACID × 1
|
ELECTRON MICROSCOPY
cryo-EM buffer
pH 7.4;OG supplemented at time of grid preparation 0.05%
cryo-EM vitrification conditions
Cryogen ETHANE;100% humidity, 3 s wait time, blot force -15
|
Resolution 3.20 Å
|
|
9MHH
PI3KC3-C1 in complex with RAB1A. VPS34 kinase domain active conformation
Deposited 2024-12-11
|
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain B
1–887(887 aa)
|
Not recorded
|
GTP GUANOSINE-5'-TRIPHOSPHATE × 2
MG MAGNESIUM ION × 2
|
ELECTRON MICROSCOPY
cryo-EM buffer
pH 7.4;OG supplemented at time of grid preparation 0.05%
cryo-EM vitrification conditions
Cryogen ETHANE
|
Resolution 4.50 Å
|
|
9NIN
The structure of human Vacuolar Protein Sorting 34 catalytic domain bound to RD-I-86
Deposited 2025-02-26
|
Different construct
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
290–871(582 aa)
|
Not recorded
|
A1BYW 2-[(8R)-pyrazolo[1,5-a]pyrimidin-3-yl]-1,3-benzothiazol-6-ol × 1
ACT ACETATE ION × 2
EDO 1,2-ETHANEDIOL × 4
PEG DI(HYDROXYETHYL)ETHER × 1
CL CHLORIDE ION × 14
K POTASSIUM ION × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6;298 K;0.1 M Ammonium acetate, 0.1 M BIS-TRIS pH 5.5, 17% w/v Polyethylene glycol 10,000
|
Resolution 2.01 Å
R-free 0.212
|
|
9ORM
The structure of human Vacuolar Protein Sorting 34 catalytic domain bound to RD-I-137
Deposited 2025-05-22
|
Different construct
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
290–871(582 aa)
|
Not recorded
|
A1CD6 ethyl 2-[(8S)-pyrazolo[1,5-a]pyrimidin-3-yl]-1,3-benzothiazole-6-carboxylate × 1
GOL GLYCEROL × 2
PEG DI(HYDROXYETHYL)ETHER × 2
CL CHLORIDE ION × 6
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION;pH 6;298 K;0.1 M Ammonium acetate, 0.1 M BIS-TRIS pH 5.5, 17% w/v Polyethylene glycol 10,000
|
Resolution 2.06 Å
R-free 0.227
|
|
9RX5
VPS34-CII (VPS34 199-REIE-202 to 199-AAAA-202 mutant) bound to RAB5A (Q79L)
Deposited 2025-07-10
|
Different mutation/modification
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 6
PDB declaration: hexameric
|
Chain A
1–887(887 aa)
|
Mutation:199-REIE-202 to 199-AAAA-202
|
No recorded non-water small molecule
|
ELECTRON MICROSCOPY
mmCIF provides none of the parsed conditions
|
Resolution 3.15 Å
|
|
9RX6
VPS34-CII (VPS34 199-REIE-202 to 199-ERIR-202 mutant) bound to RAB5A (Q79L) on the VPS15 subunit
Deposited 2025-07-10
|
Different mutation/modification
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain A
1–887(887 aa)
|
Mutation:199-REIE-202 to 199-ERIR-202
|
No recorded non-water small molecule
|
ELECTRON MICROSCOPY
mmCIF provides none of the parsed conditions
|
Resolution 3.52 Å
|
|
9RX8
Apo VPS34-CII (VPS34/VPS15/BECLIN1/UVRAG)
Deposited 2025-07-10
|
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 4
PDB declaration: tetrameric
|
Chain A
1–887(887 aa)
|
Not recorded
|
No recorded non-water small molecule
|
ELECTRON MICROSCOPY
mmCIF provides none of the parsed conditions
|
Resolution 3.87 Å
|
|
9RX9
VPS34-CII bound to RAB5A-GTP 1-212 (C19S, C63S, Q79L) on the VPS34 subunit
Deposited 2025-07-10
|
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain A
1–887(887 aa)
|
Not recorded
|
No recorded non-water small molecule
|
ELECTRON MICROSCOPY
mmCIF provides none of the parsed conditions
|
Resolution 3.99 Å
|
|
9RXA
VPS34-CII bound to RAB5A-GTP 1-212 (C19S, C63S, Q79L) on the VPS15 subunit
Deposited 2025-07-10
|
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain A
1–887(887 aa)
|
Not recorded
|
No recorded non-water small molecule
|
ELECTRON MICROSCOPY
mmCIF provides none of the parsed conditions
|
Resolution 4.00 Å
|
|
9RXB
VPS34-CII (VPS34/VPS15/BECLIN1/UVRAG) bound to RAB5A (Q79L) on the VPS34 and VPS15 subunits
Deposited 2025-07-10
|
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 6
PDB declaration: hexameric
|
Chain A
1–887(887 aa)
|
Not recorded
|
No recorded non-water small molecule
|
ELECTRON MICROSCOPY
mmCIF provides none of the parsed conditions
|
Resolution 4.03 Å
|
|
9S47
Human complex II-BATS bound to membrane-attached Rab5a-GTP
Deposited 2025-07-25
|
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain A
1–887(887 aa)
|
Not recorded
|
No recorded non-water small molecule
|
ELECTRON MICROSCOPY
mmCIF provides none of the parsed conditions
|
Resolution 9.88 Å
|
|
9ZF4
The structure of human Vacuolar Protein Sorting 34 catalytic domain bound to RD-II-83
Deposited 2025-12-01
|
Different construct
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
290–871(582 aa)
|
Not recorded
|
A1C15 methyl 2-[(8R)-pyrazolo[1,5-a]pyrimidin-3-yl]-1,3-benzothiazole-6-carboxylate × 1
GOL GLYCEROL × 1
PEG DI(HYDROXYETHYL)ETHER × 5
DMS DIMETHYL SULFOXIDE × 1
MG MAGNESIUM ION × 2
CL CHLORIDE ION × 2
K POTASSIUM ION × 1
|
X-RAY DIFFRACTION
X-ray crystallization conditions
VAPOR DIFFUSION, SITTING DROP;pH 6.5;297 K;0.2 M Sodium Chloride, 25% w/v Polyethylene glycol 3,350
|
Resolution 2.09 Å
R-free 0.224
|
|
9ZPC
Cryo-EM structure of human PI3KC3-C2
Deposited 2025-12-16
|
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Protein heterocomplex
Heteromer;Protein × 4
PDB declaration: tetrameric
|
Chain B
1–887(887 aa)
|
Not recorded
|
GDP GUANOSINE-5'-DIPHOSPHATE × 1
MG MAGNESIUM ION × 1
ZN ZINC ION × 1
|
ELECTRON MICROSCOPY
cryo-EM buffer
pH 7.5
cryo-EM vitrification conditions
Cryogen ETHANE
|
Resolution 3.83 Å
|
|
9ZPD
Cryo-EM structure of human PI3KC3-C2 in complex with Rubicon Middle Region of C terminus
Deposited 2025-12-16
|
Different oligomeric state
Different ligand/ion
Different experimental conditions
Different structure-quality metrics
|
Assembly 1
Insufficient information
Heteromer;Protein × 5
PDB declaration: pentameric
|
Chain B
1–887(887 aa)
|
Not recorded
|
GTP GUANOSINE-5'-TRIPHOSPHATE × 1
ZN ZINC ION × 1
|
ELECTRON MICROSCOPY
cryo-EM buffer
pH 7.5
cryo-EM vitrification conditions
Cryogen ETHANE
|
Resolution 3.38 Å
|