3K5F
Human BACE-1 COMPLEX WITH AYH011
Summary for 3K5F
Entry DOI | 10.2210/pdb3k5f/pdb |
Related | 3K5C 3K5D 3K5G |
Descriptor | Beta-secretase 1, (1R,3S)-3-[1-(acetylamino)-1-methylethyl]-N-[(1S,2S,4R)-1-benzyl-5-(butylamino)-2-hydroxy-4-methyl-5-oxopentyl]cyclohexanecarboxamide (3 entities in total) |
Functional Keywords | aspartyl protease, alzheimer's disease, structure-based design, disulfide bond, endoplasmic reticulum, endosome, glycoprotein, golgi apparatus, hydrolase-hydrolase inhibitor complex, membrane, protease, transmembrane, hydrolase/hydrolase inhibitor |
Biological source | Homo sapiens (human) |
Cellular location | Membrane; Single-pass type I membrane protein: P56817 |
Total number of polymer chains | 3 |
Total formula weight | 135837.11 |
Authors | Rondeau, J.-M. (deposition date: 2009-10-07, release date: 2010-05-05, Last modification date: 2017-11-01) |
Primary citation | Hanessian, S.,Shao, Z.,Betschart, C.,Rondeau, J.M.,Neumann, U.,Tintelnot-Blomley, M. Structure-based design and synthesis of novel P2/P3 modified, non-peptidic beta-secretase (BACE-1) inhibitors. Bioorg.Med.Chem.Lett., 20:1924-1927, 2010 Cited by PubMed: 20172717DOI: 10.1016/j.bmcl.2010.01.139 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.25 Å) |
Structure validation
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