2B8L

Crystal structure of human beta secretase complexed with inhibitor

Summary for 2B8L

Entry DOI	10.2210/pdb2b8l/pdb
Descriptor	Beta-secretase 1, N-[(1S,2R)-1-BENZYL-3-(CYCLOPROPYLAMINO)-2-HYDROXYPROPYL]-5-[METHYL(METHYLSULFONYL)AMINO]-N'-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE (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	45701.47
Authors	Munshi, S.K.,Kuo, L. (deposition date: 2005-10-07, release date: 2005-10-18, 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 Cited by PubMed: 16263281 DOI: 10.1016/j.bmcl.2005.10.032 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.7 Å)

Structure validation