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Ligand · 0ZA

0ZA · 3-{(1S)-1-[(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)amino]-2-phenylethyl}-1,2,4-oxadiazol-5(2H)-one

0ZA, 3-{(1S)-1-[(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)amino]-2-phenylethyl}-1,2,4-oxadiazol-5(2H)-one (C21 H21 Cl N4 O2, 396.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
0ZA
Formula
C21 H21 Cl N4 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

0ZA in 2 structures; the first of them:

  • 4HZT · Structure-based design of novel dihydroisoquinoline BACE-1 inhibitors that do not engage… · 0ZA A504 · binds GLY72, GLN73, GLY74, LEU91, ASP93, TYR132, GLN134, GLY135 and 12 more
  • 4HZT · Structure-based design of novel dihydroisoquinoline bace-1 inhibitors that do not engage… · 0ZA A504 · binds GLY72, GLN73, GLY74, LEU91, ASP93, TYR132, GLN134, GLY135 and 12 more

Residues it binds most

GLY 2, ASP 2, GLN 2, ILE 2, LYS 2, THR 2, ARG 2, ASN 2, LEU 2, PHE 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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