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Ligand · 1M9

1M9 · 2-{[(trans-4-methylcyclohexyl)carbonyl](propan-2-yl)amino}-5-[2-(trifluoromethyl)phenoxy]benzoic acid

1M9, 2-{[(trans-4-methylcyclohexyl)carbonyl](propan-2-yl)amino}-5-[2-(trifluoromethyl)phenoxy]benzoic acid (C25 H28 F3 N O4, 463.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
1M9
Formula
C25 H28 F3 N O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

1M9 in 2 structures; the first of them:

  • 4JJS · Crystal structure of HCV NS5B polymerase in complex with COMPOUND 2 · 1M9 A601 · binds LEU419, ARG422, MET423, LEU474, HIS475, SER476, TYR477, ILE482 and 5 more
  • 4JJS · Crystal structure of HCV NS5B polymerase in complex with compound 2 · 1M9 A601 · binds LEU419, ARG422, MET423, LEU474, HIS475, SER476, TYR477, ILE482 and 5 more

Residues it binds most

LEU 2, ALA 2, ARG 2, HIS 2, ILE 2, MET 2, SER 2, TRP 2, TYR 2, VAL 2 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion

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