Structure-based design of novel dihydroisoquinoline BACE-1 inhibitors that do not engage the catalytic aspartates

PDB ID: 4I0Z
Metal site ID: 4I0Z-ZN-1
Bound amino acids or nucleotide residues: D1E1
Group identifier: D1K1S1
Is homomeric: True
Amino acid or nucleotide residue IDs: ASP A.167 GLU A.165
All ligands IDs: ASP A.167 GLU A.165
Number of coordinating amino acids or nucleotide residues: 2
Number of coordinating ligands: 2
Number of coordinating chains: 2
Number of coordinating chains: 2
Representative metal site in the group: 4I0Z-ZN-1
Similar binding_sites:
Metal site idBound amino acidsBound ligands IDs
4I0Z-ZN-2D1E1 ASP A.167 GLU A.165