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Ligand · QGY

QGY · (1P)-2-amino-5-bromo-1-(3-hydroxy-2,6-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

QGY, (1P)-2-amino-5-bromo-1-(3-hydroxy-2,6-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide (C19 H16 Br N5 O2, 426.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
QGY
Formula
C19 H16 Br N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

QGY in 2 structures; the first of them:

  • 8D6D · Crystal Structure of Human Myt1 Kinase domain Bounded with compound 39 · QGY A405 · binds LEU116, TYR121, VAL124, ALA137, VAL138, LYS139, GLU157, HIS161 and 12 more
  • 8D6D · Crystal structure of human MYT1 kinase domain bounded with compound 39 · QGY A405 · binds LEU116, TYR121, VAL124, ALA137, LYS139, GLU157, HIS161, VAL171 and 9 more

Residues it binds most

VAL 4, LEU 4, GLY 4, GLU 4, PHE 4, ALA 4, ASP 4, CYS 4, GLN 4, HIS 4 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion
  • EDO · 1,2-ethanediol

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