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Ligand · XRP

XRP · 3-{[(4-methylphenyl)methyl]sulfanyl}-1-phenyl-1H-1,2,4-triazole

XRP, 3-{[(4-methylphenyl)methyl]sulfanyl}-1-phenyl-1H-1,2,4-triazole (C16 H15 N3 S, 281.4 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, the residues it…

Component
XRP
Formula
C16 H15 N3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

XRP in 2 structures; the first of them:

  • 7LAF · 15-lipoxygenase-2 loop mutant bound to imidazole-based inhibitor · XRP A702 · binds PHE365, GLU369, HIS373, LEU374, HIS378, ILE412, LEU415, ALA416 and 6 more
  • 7LAF · 15-lipoxygenase-2 loop mutant bound to imidazole-based inhibitor · XRP A702 · binds GLU369, HIS373, LEU374, HIS378, ILE412, LEU415, ALA416, LEU420 and 4 more

Residues it binds most

LEU 4, HIS 4, PHE 4, ILE 4, ALA 4, GLU 4, VAL 4, THR 2 (residue and the binding sites it lines).

Found with

  • MN · Manganese (II) ion

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