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Ligand · 53K

53K · 2-(2-methylphenoxy)-5-[(4-phenyl-1H-1,2,3-triazol-1-yl)methyl]phenol

53K, 2-(2-methylphenoxy)-5-[(4-phenyl-1H-1,2,3-triazol-1-yl)methyl]phenol (C22 H19 N3 O2, 357.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues…

Component
53K
Formula
C22 H19 N3 O2
Class
ligand
Structures
1
PDB entries
1

Binding sites

53K in 1 structure; the first of them:

  • 5MTP · Crystal structure of M. tuberculosis inha inhibited by PT514 · 53K A302 · binds GLY96, PHE97, MET98, MET103, PHE149, MET155, PRO156, ALA157 and 10 more

Residues it binds most

MET 8, LEU 8, PHE 8, ALA 8, GLN 8, GLY 8, LYS 8, PRO 8, TYR 8, ILE 7 (residue and the binding sites it lines).

Found with

  • NAD · Nicotinamide-adenine-dinucleotide
  • NA · Sodium ion
  • CL · Chloride ion

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