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Ligand · 3XS

3XS · 2-[(E)-{2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]hydrazinylidene}methyl]benzoic acid

3XS, 2-[(E)-{2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]hydrazinylidene}methyl]benzoic acid (C18 H15 N3 O3 S, 353.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
3XS
Formula
C18 H15 N3 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

3XS in 2 structures; the first of them:

  • 4LS2 · Crystal structure of human dihydroorotate dehydrogenase (DHODH) with DH03A313 · 3XS A409 · binds TYR38, LEU42, MET43, LEU46, GLN47, PRO52, ALA55, HIS56 and 13 more
  • 4LS2 · Crystal structure of human dihydroorotate dehydrogenase (dhodh) with DH03A313 · 3XS A409 · binds TYR38, LEU42, MET43, LEU46, GLN47, PRO52, ALA55, HIS56 and 13 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

  • FMN · Flavin mononucleotide
  • ORO · Orotic acid
  • SO4 · Sulfate ion
  • ACT · Acetate ion

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