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MolNFT v1 · #179948 · protein

Structure of the catalytic domain of tankyrase 1 in complex with niraparib

7KKP: “Structure of the catalytic domain of tankyrase 1 in complex with niraparib”. X-ray diffraction, 3 ligands (3JD, ZN, SO4). MolNFT v1 #179948 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7KKP
Type
protein
Length
412 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q59FX0
Ligands
3JD, ZN, SO4

Structure

x-ray diffraction · 2 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein204—Q59FX0
B—protein208—Q59FX0

Ligands and binding sites

  • 3JD · 2-{4-[(3S)-piperidin-3-yl]phenyl}-2H-indazole-7-carboxamide · ligand · 2 copies · chains A, B
  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • SO4 · Sulfate ion · ion · 7 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 7KKP · Structure of the catalytic domain of tankyrase 1 in complex with niraparib · the same entry in another collection · chain A against A, TM-score 1.00

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