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

PDB ID: 4I0Z
Gene source organism: Homo sapiens
Expression organism: Escherichia coli Deposition date: 2012-11-19
Classification: hydrolase/hydrolase inhibitor
Keywords: Aspartic protease, hydrolase-hydrolase inhibitor complex
Technique: X-RAY DIFFRACTION
Assembly: 2
Resolution: 1.8
R-value: 0.20644
Metal site idBound amino acidsBound ligands IDs
4I0Z-ZN-1 D1E1 ASP A.167 GLU A.165
4I0Z-ZN-2 D1E1 ASP A.167 GLU A.165