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Ligand · 4U9

4U9 · 5-[4-bromo-2-(2-chloro-6-fluorophenyl)-1H-imidazol-5-yl]-2-{[4-(trifluoromethyl)phenyl]ethynyl}pyridine

4U9, 5-[4-bromo-2-(2-chloro-6-fluorophenyl)-1H-imidazol-5-yl]-2-{[4-(trifluoromethyl)phenyl]ethynyl}pyridine (C23 H11 Br Cl F4 N3, 520.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
4U9
Formula
C23 H11 Br Cl F4 N3
Class
ligand
Structures
2
PDB entries
1

Binding sites

4U9 in 2 structures; the first of them:

  • 4YL3 · Crystal Structures of mPGES-1 Inhibitor Complexes · 4U9 A201 · binds ALA123, PRO124, ARG126, SER127, VAL128, THR131, LEU132, LEU135
  • 4YL3 · Crystal structures of mpges-1 inhibitor complexes · 4U9 A201 · binds ALA123, PRO124, ARG126, SER127, VAL128, THR131, LEU132, LEU135

Residues it binds most

LEU 2, ALA 2, ARG 2, PRO 2, SER 2, THR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • GSH · Glutathione
  • BOG · octyl beta-D-glucopyranoside
  • PG4 · Tetraethylene glycol

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