2NTR
Crystal structure of Human Bace-1 bound to inhibitor
Summary for 2NTR
Entry DOI | 10.2210/pdb2ntr/pdb |
Related | 1TQF 2B8V 2IRZ 2IS0 |
Descriptor | Beta-secretase 1, (2R)-2-(5-{3-chloro-6-((2-methoxyethyl){[(1S,2S)-2-methylcyclopropyl]methyl}amino)-2-[methyl(methylsulfonyl)amino]pyrid in-4-yl}-1,3,4-oxadiazol-2-yl)-1-phenylpropan-2-amine (3 entities in total) |
Functional Keywords | bace, aspartyl protease, 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 | 45685.86 |
Authors | Munshi, S. (deposition date: 2006-11-08, release date: 2007-11-13, Last modification date: 2023-08-30) |
Primary citation | McGaughey, G.B.,Colussi, D.,Graham, S.L.,Lai, M.T.,Munshi, S.K.,Nantermet, P.G.,Pietrak, B.,Rajapakse, H.A.,Selnick, H.G.,Stauffer, S.R.,Holloway, M.K. Beta-secretase (BACE-1) inhibitors: accounting for 10s loop flexibility using rigid active sites. Bioorg.Med.Chem.Lett., 17:1117-1121, 2007 Cited by PubMed: 17112725DOI: 10.1016/j.bmcl.2006.11.003 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.8 Å) |
Structure validation
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