MolNFT v1 · #160936 · protein
Human PI3KALPHA in complex with compound 2-10 ((3S)-3-benzyl-3-methyl- 5-[5-(2-methylpyrimidin-5-YL)PYRAZOLO[1,5-A]PYRIMIDIN-3-yl]-1,3- dihydro-2H-indol-2-one)
6PYS: “Human PI3KALPHA in complex with compound 2-10 ((3S)-3-benzyl-3-methyl…”. X-ray diffraction, 1 ligand (P5J). MolNFT v1 #160936 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 6PYS
- Type
- protein
- Length
- 890 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P42336
- Ligands
- P5J
Structure
x-ray diffraction · 1 distinct chain.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 890 | — | P42336 |
Ligands and binding sites
- P5J · (3S)-3-benzyl-3-methyl-5-[5-(2-methylpyrimidin-5-yl) pyrazolo[1,5-a]pyrimidin-3-yl]-1,3-dihydro-2H-indol-2-one · ligand · chains A
- GOL · Glycerol · additive · 2 copies · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 6PYS · Human PI3Kalpha in complex with Compound 2-10 ((3S)-3-benzyl-3-methyl-5-[5-(2-methylpyrimi… · the same entry in another collection · chain A against A, TM-score 1.00
- P42336 · 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 0.99
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 P42336
- Elsewhere: RCSB PDB 6PYS · PDBe 6PYS · UniProt P42336
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