MolNFT v1 · #179929 · protein
Structure of the catalytic domain of PARP1 in complex with veliparib
7KK6: “Structure of the catalytic domain of PARP1 in complex with veliparib”. X-ray diffraction, 2 ligands (78P, SO4). MolNFT v1 #179929 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7KK6
- Type
- protein
- Length
- 700 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- UniProt
- P09874
- Ligands
- 78P, SO4
Structure
x-ray diffraction · 2 distinct chains.
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | — | protein | 351 | — | P09874 |
| B | — | protein | 349 | — | P09874 |
Ligands and binding sites
- 78P · (2R)-2-(7-carbamoyl-1H-benzimidazol-2-yl)-2-methylpyrrolidinium · ligand · 2 copies · chains A, B
- SO4 · Sulfate ion · ion · 5 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Compared structures
- 7KK6 · Structure of the catalytic domain of PARP1 in complex with veliparib · the same entry in another collection · chain A against A, TM-score 1.00
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 P09874
- Elsewhere: RCSB PDB 7KK6 · PDBe 7KK6 · UniProt P09874
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