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Ligand · 0UW

0UW · 5-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one

0UW, 5-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one (C8 H7 N3 O, 161.2 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 binds most and the…

Component
0UW
Formula
C8 H7 N3 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

0UW in 2 structures; the first of them:

  • 7N5R · Fragment-Based Discovery of a Novel Bruton's Tyrosine Kinase Inhibitor · 0UW A704 · binds LEU408, VAL416, ALA428, LYS430, VAL458, THR474, GLU475, TYR476 and 4 more
  • 7N5R · Fragment-based discovery of a novel BRUTON'S tyrosine kinase inhibitor · 0UW A704 · binds LEU408, VAL416, ALA428, LYS430, VAL458, THR474, GLU475, TYR476 and 4 more

Residues it binds most

LEU 2, VAL 2, ALA 2, GLU 2, GLY 2, LYS 2, MET 2, SER 2, THR 2, TYR 2 (residue and the binding sites it lines).

Found with

  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol
  • IMD · Imidazole

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