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Ligand · 591

591 · (5S)-2-amino-5-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-5-[3-(pyrimidin-5-yl)phenyl]-3,5-dihydro-4H-imidazol-4-one

591, (5S)-2-amino-5-(1-ethyl-1H-pyrazol-4-yl)-3-methyl-5-[3-(pyrimidin-5-yl)phenyl]-3,5-dihydro-4H-imidazol-4-one (C19 H19 N7 O, 361.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
591
Formula
C19 H19 N7 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

591 in 2 structures; the first of them:

  • 3S7L · Pyrazolyl and Thienyl Aminohydantoins as Potent BACE1 Inhibitors · 591 A1 · binds GLY73, GLN74, GLY75, LEU92, ASP94, GLY96, SER97, VAL131 and 11 more
  • 3S7L · Pyrazolyl and thienyl aminohydantoins as potent BACE1 inhibitors · 591 A1 · binds GLY73, GLN74, GLY75, LEU92, ASP94, GLY96, SER97, VAL131 and 11 more

Residues it binds most

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

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