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Ligand · 4UK

4UK · N-[4-(4-chlorophenyl)-1H-imidazol-2-yl]-2-(difluoromethyl)-5-{[(2-methylpropanoyl) amino]methyl}benzamide

4UK, N-[4-(4-chlorophenyl)-1H-imidazol-2-yl]-2-(difluoromethyl)-5-{[(2-methylpropanoyl) amino]methyl}benzamide (C22 H21 Cl F2 N4 O2, 446.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
4UK
Formula
C22 H21 Cl F2 N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

4UK in 2 structures; the first of them:

  • 5BQH · Discovery of a Potent and Selective mPGES-1 Inhibitor for the Treatment of Pain · 4UK A201 · binds ALA123, PRO124, ARG126, SER127, VAL128, TYR130, THR131, LEU132
  • 5BQH · Discovery of a potent and selective mpges-1 inhibitor for the treatment of pain · 4UK A201 · binds ALA123, PRO124, ARG126, SER127, VAL128, TYR130, THR131, LEU132

Residues it binds most

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

Found with

  • 1KA · (2-hydroxyethoxy)acetaldehyde
  • GSH · Glutathione
  • BOG · octyl beta-D-glucopyranoside
  • PG4 · Tetraethylene glycol

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