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MolNFT v1 · #166878 · protein

Human POLY(ADP-ribose) polymerase 12, catalytic fragment with four point mutations in complex with rbn-2397

6V3W: “Human POLY(ADP-ribose) polymerase 12, catalytic fragment with four point mutations in complex with rbn-2397”. X-ray diffraction, 2 ligands (QO4, CL). MolNFT v1 #166878 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6V3W
Type
protein
Length
183 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q9H0J9
Ligands
QO4, CL

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein183—Q9H0J9

Ligands and binding sites

  • QO4 · 5-{[(2S)-1-(3-oxo-3-{4-[5-(trifluoromethyl)pyrimidin-2-yl]piperazin-1-yl}propoxy)propan-2-yl]amino}-4-(trifluoromethyl)pyridazin-3(2H)-one · ligand · chains A
  • CL · Chloride ion · ion · chains A

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

Compared structures

  • 6V3W · Human Poly(ADP-Ribose) Polymerase 12, Catalytic fragment with four point mutations in… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9H0J9 · AlphaFold monomer V2.0 prediction for protein mono-ADP- ribosyltransferase PARP12 (Q9H0J9) · a predicted model of the same protein · chain A against A, TM-score 0.98

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