3INE
Bace1 with the aminohydantoin Compound S-34
Summary for 3INE
Entry DOI | 10.2210/pdb3ine/pdb |
Related | 3IND 3INF 3INH |
Descriptor | Beta-secretase 1, (5S)-2-amino-5-(4-methoxy-3-methylphenyl)-3-methyl-5-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yl]-3,5-dihydro-4H-imidazol-4-one (3 entities in total) |
Functional Keywords | bace1, xray, inhibitor, alternative splicing, aspartyl protease, disulfide bond, glycoprotein, hydrolase, membrane, polymorphism, protease, transmembrane, zymogen |
Biological source | Homo sapiens (human) |
Cellular location | Membrane; Single-pass type I membrane protein: P56817 |
Total number of polymer chains | 1 |
Total formula weight | 46808.47 |
Authors | Olland, A.M.,Chopra, R. (deposition date: 2009-08-12, release date: 2010-03-02, Last modification date: 2023-09-06) |
Primary citation | Malamas, M.S.,Erdei, J.,Gunawan, I.,Turner, J.,Hu, Y.,Wagner, E.,Fan, K.,Chopra, R.,Olland, A.,Bard, J.,Jacobsen, S.,Magolda, R.L.,Pangalos, M.,Robichaud, A.J. Design and synthesis of 5,5'-disubstituted aminohydantoins as potent and selective human beta-secretase (BACE1) inhibitors. J.Med.Chem., 53:1146-1158, 2010 Cited by PubMed: 19968289DOI: 10.1021/jm901414e PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.996 Å) |
Structure validation
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