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Ligand · WJ1

WJ1 · (S)-2-chloro-3-phenylpropanoic acid

WJ1, (S)-2-chloro-3-phenylpropanoic acid (C9 H9 Cl O2, 184.6 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands…

Component
WJ1
Formula
C9 H9 Cl O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

WJ1 in 4 structures; the first of them:

  • 4DZY · Crystal structure of branched-chain alpha-ketoacid dehydrogenase… · WJ1 A404 · binds LEU68, ILE72, TYR99, LEU106, VAL125, LEU128, LEU129, HIS132 and 5 more
  • 4E02 · Crystal structure of branched-chain alpha-ketoacid dehydrogenase… · WJ1 A403 · binds LEU68, ILE72, TYR99, LEU106, VAL125, LEU128, LEU129, HIS132 and 5 more
  • 4DZY · Crystal structure of branched-chain alpha-ketoacid dehydrogenase… · WJ1 A404 · binds LEU68, ILE72, TYR99, LEU106, VAL125, LEU128, LEU129, HIS132 and 5 more
  • 4E02 · Crystal structure of branched-chain alpha-ketoacid dehydrogenase… · WJ1 A403 · binds LEU68, ILE72, TYR99, LEU106, VAL125, LEU128, LEU129, HIS132 and 5 more

Residues it binds most

LEU 4, ARG 4, ILE 4, VAL 4, ALA 4, HIS 4, TYR 4 (residue and the binding sites it lines).

Found with

  • K · Potassium ion
  • MG · Magnesium ion
  • ADP · Adenosine-5'-diphosphate
  • ANP · Phosphoaminophosphonic acid-adenylate ester

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