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Ligand · U8N

U8N · 4-oxidanyl-2~{H}-isoquinolin-1-one

U8N, 4-oxidanyl-2~{H}-isoquinolin-1-one (C9 H7 N O2, 161.2 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 ligands found…

Component
U8N
Formula
C9 H7 N O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

U8N in 2 structures; the first of them:

  • 7NDM · Crystal structure of the heterocyclic toxin methyltransferase from Mycobacterium… · U8N A302 · binds PRO29, TRP30, HIS125, PHE154, ILE164, ALA192, PHE194, PHE198
  • 7NDM · Crystal structure of the heterocyclic toxin methyltransferase from mycobacterium… · U8N A302 · binds PRO29, TRP30, HIS125, PHE154, ILE164, ALA192, PHE194, PHE198

Residues it binds most

PHE 2, ALA 2, HIS 2, ILE 2, PRO 2, TRP 2 (residue and the binding sites it lines).

Found with

  • SAH · S-adenosyl-L-homocysteine
  • NA · Sodium ion
  • MLI · Malonate ion

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