6PZ4
co-crystal structure of BACE with inhibitor AM-6494
Summary for 6PZ4
Entry DOI | 10.2210/pdb6pz4/pdb |
Descriptor | Beta-secretase 1, IODIDE ION, GLYCEROL, ... (5 entities in total) |
Functional Keywords | bace, inhibitor, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 1 |
Total formula weight | 46916.87 |
Authors | Huang, X. (deposition date: 2019-07-31, release date: 2019-10-23, Last modification date: 2024-10-09) |
Primary citation | Pettus, L.H.,Bourbeau, M.P.,Bradley, J.,Bartberger, M.D.,Chen, K.,Hickman, D.,Johnson, M.,Liu, Q.,Manning, J.R.,Nanez, A.,Siegmund, A.C.,Wen, P.H.,Whittington, D.A.,Allen, J.R.,Wood, S. Discovery of AM-6494: A Potent and Orally Efficacious beta-Site Amyloid Precursor Protein Cleaving Enzyme 1 (BACE1) Inhibitor with in Vivo Selectivity over BACE2. J.Med.Chem., 63:2263-2281, 2020 Cited by PubMed: 31589043DOI: 10.1021/acs.jmedchem.9b01034 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.85 Å) |
Structure validation
Download full validation report