MolNFT v1 · #159056 · protein
Human PI3KDELTA in complex with compound 29
6OCU: “Human PI3KDELTA in complex with compound 29”. X-ray diffraction, 1 ligand (M5D). MolNFT v1 #159056 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6OCU
- Type
- protein
- Length
- 1,074 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- O00329, P23727
- Ligands
- M5D
Structure
x-ray diffraction · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 910 | — | O00329 |
| B | — | protein | 164 | — | P23727 |
Ligands and binding sites
- M5D · 5-{(3R)-3-methyl-4-[(1R,2R)-2-methylcyclopropane-1-carbonyl]piperazin-1-yl}-3-(1-methyl-1H-pyrazol-4-yl) pyrazine-2-carbonitrile · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6OCU · Human PI3KDELTA in complex with compound 29 · the same entry in another collection · chain A against A, TM-score 1.00
- O00329 · AlphaFold monomer V2.0 prediction for phosphatidylinositol 4,5-bisphosphate 3-kinase… · a predicted model of the same protein · chain A against A, TM-score 0.98
- P23727 · AlphaFold monomer V2.0 prediction for phosphatidylinositol 3-kinase regulatory subunit… · a predicted model of the same protein · chain B against A, TM-score 0.94
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt O00329
- Every structure of UniProt P23727
- Elsewhere: RCSB PDB 6OCU · PDBe 6OCU · UniProt O00329 · UniProt P23727
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