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Ligand · 951

951 · 2-[(2E)-2-{[5-(2-chlorophenyl)furan-2-yl]methylidene}hydrazino]benzoic acid

951, 2-[(2E)-2-{[5-(2-chlorophenyl)furan-2-yl]methylidene}hydrazino]benzoic acid (C18 H13 Cl N2 O3, 340.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
951
Formula
C18 H13 Cl N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

951 in 2 structures; the first of them:

  • 3KVM · Crystal structure of human dihydroorotate dehydrogenase (DHODH) with amino-benzoic acid… · 951 A402 · binds TYR38, MET43, LEU46, GLN47, PRO52, ALA55, HIS56, ALA59 and 12 more
  • 3KVM · Crystal structure of human dihydroorotate dehydrogenase (dhodh) with amino-benzoic acid… · 951 A402 · binds TYR38, MET43, LEU46, GLN47, PRO52, ALA55, HIS56, ALA59 and 12 more

Residues it binds most

LEU 2, ALA 2, MET 2, PHE 2, PRO 2, THR 2, TYR 2, ARG 2, GLN 2, HIS 2 (residue and the binding sites it lines).

Found with

  • DET · Undecylamine-N,N-dimethyl-N-oxide
  • DOR · (4S)-2,6-dioxohexahydropyrimidine-4-carboxylic acid
  • FMN · Flavin mononucleotide
  • SO4 · Sulfate ion
  • ACT · Acetate ion

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