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Ligand · GJW

GJW · 7-(pyrrolidin-1-ylmethyl)pyrrolo[1,2-a]quinoxalin-4(5H)-one

GJW, 7-(pyrrolidin-1-ylmethyl)pyrrolo[1,2-a]quinoxalin-4(5H)-one (C16 H17 N3 O, 267.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
GJW
Formula
C16 H17 N3 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

GJW in 2 structures; the first of them:

  • 3GJW · PARP complexed with A968427 · GJW A351 · binds ASP105, ASP109, TRP200, HIS201, GLY202, SER203, ASN207, TYR235 and 6 more
  • 3GJW · Parp complexed with A968427 · GJW A351 · binds ASP105, ASP109, TRP200, HIS201, GLY202, SER203, ASN207, TYR235 and 6 more

Residues it binds most

ASP 2, SER 2, TYR 2, ALA 2, ASN 2, GLU 2, GLY 2, HIS 2, LYS 2, PHE 2 (residue and the binding sites it lines).

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