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Ligand · BPU

BPU · 7-bromopyrrolo[1,2-a]quinoxalin-4(5H)-one

BPU, 7-bromopyrrolo[1,2-a]quinoxalin-4(5H)-one (C11 H7 Br N2 O, 263.1 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 most and the…

Component
BPU
Formula
C11 H7 Br N2 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

BPU in 2 structures; the first of them:

  • 3P0N · Human Tankyrase 2 - Catalytic PARP domain in complex with an inhibitor · BPU A1163 · binds PHE1030, HIS1031, GLY1032, HIS1048, TYR1050, TYR1060, PHE1061, ALA1062 and 5 more
  • 3P0N · Human tankyrase 2 - catalytic parp domain in complex with an inhibitor · BPU A1163 · binds PHE1030, HIS1031, GLY1032, HIS1048, TYR1050, TYR1060, PHE1061, ALA1062 and 5 more

Residues it binds most

TYR 4, HIS 4, PHE 4, ALA 4, GLU 4, GLY 4, ILE 4, LYS 4, SER 4 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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