2B8V

Crystal structure of human Beta-secretase complexed with L-L000430,469

Summary for 2B8V

• Entry DOI: 10.2210/pdb2b8v/pdb
• Related: 1TQF
• Descriptor: Beta-secretase 1, 3-BENZOYL-N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]BENZAMIDE (3 entities in total)
• Functional Keywords: aspartyl protease, bace, hydrolase
• Biological source: Homo sapiens (human)
• Cellular location: Membrane; Single-pass type I membrane protein: P56817
• Total number of polymer chains: 1
• Total formula weight: 45658.40

Authors

Stachel, S.J.,Coburn, C.A.,Steele, T.G.,Crouthamel, M.-C.,Pietrak, B.L.,Lai, M.-T.,Holloway, M.K.,Munshi, S.K.,Graham, S.L.,Vacca, J.P. (deposition date: 2005-10-10, release date: 2005-12-06, Last modification date: 2023-08-23)

• Primary citation: Stachel, S.J.,Coburn, C.A.,Steele, T.G.,Crouthamel, M.-C.,Pietrak, B.L.,Lai, M.-T.,Holloway, M.K.,Munshi, S.K.,Graham, S.L.,Vacca, J.P.; Conformationally biased P3 amide replacements of beta-secretase inhibitors.; Bioorg.Med.Chem.Lett., 16:641-644, 2006; PubMed: 16263281; DOI: 10.1016/j.bmcl.2005.10.032

Experimental method

X-RAY DIFFRACTION (1.8 Å)