3CID
Structure of BACE Bound to SCH726222
Summary for 3CID
Entry DOI | 10.2210/pdb3cid/pdb |
Related | 2QK5 2QKJ 2QMD 3CIB 3CIC |
Descriptor | Beta-secretase 1, N'-[(1S,2S)-2-[(4S)-1-benzyl-5-oxoimidazolidin-4-yl]-1-(3,5-difluorobenzyl)-2-hydroxyethyl]-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide, D(-)-TARTARIC ACID, ... (4 entities in total) |
Functional Keywords | bace1, aspartyl protease, hydrolase |
Biological source | Homo sapiens (human) |
Cellular location | Membrane; Single-pass type I membrane protein: P56817 |
Total number of polymer chains | 2 |
Total formula weight | 88515.59 |
Authors | Strickland, C.,Cumming, J. (deposition date: 2008-03-11, release date: 2008-06-10, Last modification date: 2017-10-25) |
Primary citation | Cumming, J.N.,Le, T.X.,Babu, S.,Carroll, C.,Chen, X.,Favreau, L.,Gaspari, P.,Guo, T.,Hobbs, D.W.,Huang, Y.,Iserloh, U.,Kennedy, M.E.,Kuvelkar, R.,Li, G.,Lowrie, J.,McHugh, N.A.,Ozgur, L.,Pan, J.,Parker, E.M.,Saionz, K.,Stamford, A.W.,Strickland, C.,Tadesse, D.,Voigt, J.,Wang, L.,Wu, Y.,Zhang, L.,Zhang, Q. Rational design of novel, potent piperazinone and imidazolidinone BACE1 inhibitors Bioorg.Med.Chem.Lett., 18:3236-3241, 2008 Cited by PubMed: 18468890DOI: 10.1016/j.bmcl.2008.04.050 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.8 Å) |
Structure validation
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