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Ligand · QGI

QGI · (1P)-2-amino-1-(3-hydroxy-2,6-dimethylphenyl)-5,6-dimethyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

QGI, (1P)-2-amino-1-(3-hydroxy-2,6-dimethylphenyl)-5,6-dimethyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide (C18 H20 N4 O2, 324.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
QGI
Formula
C18 H20 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

QGI in 2 structures; the first of them:

  • 8D6E · Crystal Structure of Human Myt1 Kinase domain Bounded with RP-6306 · QGI B402 · binds LEU116, TYR121, VAL124, ALA137, LYS139, HIS161, VAL171, THR187 and 7 more
  • 8D6E · Crystal structure of human MYT1 kinase domain bounded with rp-6306 · QGI B402 · binds LEU116, TYR121, VAL124, ALA137, LYS139, HIS161, VAL171, THR187 and 7 more

Residues it binds most

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

Found with

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

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