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Ligand · 4RQ

4RQ · N-(3,5-dichlorobenzyl)-N'-(5-fluoro-1H-imidazo[4,5-b]pyridin-2-yl)propane-1,3-diamine

4RQ, N-(3,5-dichlorobenzyl)-N'-(5-fluoro-1H-imidazo[4,5-b]pyridin-2-yl)propane-1,3-diamine (C16 H16 Cl2 F N5, 368.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
4RQ
Formula
C16 H16 Cl2 F N5
Class
ligand
Structures
2
PDB entries
1

Binding sites

4RQ in 2 structures; the first of them:

  • 4ZT3 · Trypanosoma brucei methionyl-tRNA synthetase in complex with inhibitor… · 4RQ B806 · binds PRO247, ILE248, TYR250, ASP287, HIS289, GLY290, GLN291, LEU456 and 11 more
  • 4ZT3 · Trypanosoma brucei methionyl-tRNA synthetase in complex with inhibitor… · 4RQ B806 · binds PRO247, ILE248, TYR250, ASP287, HIS289, GLY290, GLN291, LEU456 and 11 more

Residues it binds most

TYR 2, ASP 2, HIS 2, ILE 2, LEU 2, VAL 2, ALA 2, GLN 2, GLY 2, PHE 2 (residue and the binding sites it lines).

Found with

  • MET · Methionine
  • SO4 · Sulfate ion
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol

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