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Ligand · X8D

X8D · 5-methyl[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one

X8D, 5-methyl[1,2,4]triazolo[4,3-a]quinolin-1(2H)-one (C11 H9 N3 O, 199.2 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…

Component
X8D
Formula
C11 H9 N3 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

X8D in 2 structures; the first of them:

  • 2X8D · Discovery of a Novel Class of triazolones as Checkpoint Kinase Inhibitors - Hit to Lead… · X8D A1282 · binds LEU15, GLY16, VAL23, ALA36, LEU84, GLU85, TYR86, CYS87 and 3 more
  • 2X8D · Discovery of a novel class of triazolones as checkpoint kinase inhibitors - hit to lead… · X8D A1282 · binds LEU15, GLY16, VAL23, ALA36, LEU84, GLU85, TYR86, CYS87 and 3 more

Residues it binds most

LEU 2, GLU 2, GLY 2, ALA 2, CYS 2, TYR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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