2PH6

Crystal Structure of Human Beta Secretase Complexed with inhibitor

Summary for 2PH6

Entry DOI	10.2210/pdb2ph6/pdb
Related	1TQF
Descriptor	Beta-secretase 1, SULFATE ION, 3-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)-5-[METHYL(METHYLSULFONYL)AMINO]BENZYL ALPHA-METHYL-D-PHENYLALANINATE, ... (4 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	45760.45
Authors	Munshi, S. (deposition date: 2007-04-10, release date: 2007-06-05, Last modification date: 2023-08-30)
Primary citation	Lindsley, S.R.,Moore, K.P.,Rajapakse, H.A.,Selnick, H.G.,Young, M.B.,Zhu, H.,Munshi, S.,Kuo, L.,McGaughey, G.B.,Colussi, D.,Crouthamel, M.C.,Lai, M.T.,Pietrak, B.,Price, E.A.,Sankaranarayanan, S.,Simon, A.J.,Seabrook, G.R.,Hazuda, D.J.,Pudvah, N.T.,Hochman, J.H.,Graham, S.L.,Vacca, J.P.,Nantermet, P.G. Design, synthesis, and SAR of macrocyclic tertiary carbinamine BACE-1 inhibitors. Bioorg.Med.Chem.Lett., 17:4057-4061, 2007 Cited by PubMed: 17482814 DOI: 10.1016/j.bmcl.2007.04.072 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2 Å)

Structure validation