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MolNFT v2 · #184637 · protein

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

7KKN: “Structure of the catalytic domain of tankyrase 1 in complex with talazoparib”. X-ray diffraction at 1.48, 2 ligands (2YQ, ZN). MolNFT v2 #184637 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7KKN
Type
protein
Length
834 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.48
Source
Homo sapiens
UniProt
Q59FX0
Ligands
2YQ, ZN

Structure

x-ray diffraction · resolution 1.48 · 3 distinct chains.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein207—Q59FX0
B, D—protein210—Q59FX0
C—protein207—Q59FX0

Ligands and binding sites

  • 2YQ · (8S,9R)-5-fluoro-8-(4-fluorophenyl)-9-(1-methyl-1H-1,2, 4-triazol-5-yl)-2,7,8,9-tetrahydro-3H-pyrido[4,3,2-de]phthalazin-3-one · ligand · 4 copies · chains A, B, C, D
  • ZN · Zinc ion · metal · 4 copies · chains A, B, C, D
  • MES · 2-(N-morpholino)-ethanesulfonic acid · additive · 2 copies · chains A, B

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

Compared structures

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

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