PDB ID: 4DI2
Hetero Atom Contents
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0K9 | (2r)-N-{(2s,3r)-4-{[(4'S)-6'-(2,2-dimethylpropyl)-3',4'-dihydrospiro[cyclobutane-1,2'-pyrano[2,3-B]pyridin]-4'-yl]amino}-3-hydroxy-1-[3-(1,3-thiazol-2-yl)phenyl]butan-2-yl}-2-methoxypropanamide | PoSSuM | |||
GOL | Glycerol | PoSSuM |
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Download interaction data: 4DI2
Structure summary
Code : | 4DI2 PDBj RCSB PDB PDBe | ||||||||||||
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Header : | HYDROLASE/HYDROLASE INHIBITOR | ||||||||||||
Title : | Crystal structure of BACE1 in complex with hydroxyethylamine inhibitor 37 | ||||||||||||
Release Data : | 2012-10-10 | ||||||||||||
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Authors : | Whittington, D.A., Long, A.M. | ||||||||||||
Keywords : | memapsin-2, Alzheimer's disease, protease, beta-site amyloid precursor protein cleaving enzyme 1, APP, HYDROLASE-HYDROLASE INHIBITOR complex | ||||||||||||
Exp. method : | X-RAY DIFFRACTION ( 2.00 Å ) | ||||||||||||
Citation : |
Design and synthesis of potent, orally efficacious hydroxyethylamine derived beta-site amyloid precursor protein cleaving enzyme (BACE1) inhibitors.
Dineen, T.A.,Weiss, M.M.,Williamson, T.
et al.
PubMed: 22468684 |
Reaction
Chain : | A, B, C | ||||||||
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UniProt : | P56817 (BACE1_HUMAN) | ||||||||
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