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Ligand · 46R

46R · N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide

46R, N-(2,2,2-trifluoroethyl)-1,2-oxazole-3-carboxamide (C6 H5 F3 N2 O2, 194.1 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…

Component
46R
Formula
C6 H5 F3 N2 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

46R in 2 structures; the first of them:

  • 4Y4E · Endothiapepsin in complex with fragment 131 · 46R A403 · binds GLY37, SER38, ILE77, SER78, TYR79, GLY80, LEU133, PHE194 and 4 more
  • 4Y4E · Endothiapepsin in complex with fragment 131 · 46R A403 · binds GLY37, SER38, ILE77, SER78, TYR79, GLY80, LEU133, PHE194 and 4 more

Residues it binds most

ILE 2, GLY 2, SER 2, ASP 2, LEU 2, PHE 2, THR 2, TYR 2 (residue and the binding sites it lines).

Found with

  • ACT · Acetate ion
  • GOL · Glycerol
  • PGE · Triethylene glycol

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