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MolNFT v1 · #128445 · protein

Human PARP14 (ARTD8), catalytic fragment in complex with an N-aryl piperazine inhibitor

5NQE: “Human PARP14 (ARTD8), catalytic fragment in complex with an N-aryl piperazine inhibitor”. X-ray diffraction, 1 ligand (94Z). MolNFT v1 #128445 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5NQE
Type
protein
Length
360 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q460N5
Ligands
94Z

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B—protein180—Q460N5

Ligands and binding sites

  • 94Z · 3-[[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butanoyl]amino]benzamide · ligand · 2 copies · chains A, B

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

Compared structures

  • 5NQE · Human PARP14 (ARTD8), catalytic fragment in complex with an N-aryl piperazine inhibitor · the same entry in another collection · chain A against A, TM-score 1.00
  • Q460N5 · AlphaFold monomer V2.0 prediction for protein mono-ADP- ribosyltransferase PARP14 (Q460N5) · a predicted model of the same protein · chain A against A, TM-score 0.95

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