PDB ID: 3WB5
Hetero Atom Contents
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Code | Name | Style | Show | Link | |
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0B4 | (6s)-2-amino-3,6-dimethyl-6-[(1r,2r)-2-phenylcyclopropyl]-5,6-dihydropyrimidin-4(3h)-one | PoSSuM | |||
DMS | Dimethyl sulfoxide | PoSSuM | |||
GOL | Glycerol | PoSSuM | |||
IOD | Iodide ion | PoSSuM |
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Download interaction data: 3WB5
Structure summary
Code : | 3WB5 PDBj RCSB PDB PDBe | ||||||||||||
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Header : | HYDROLASE | ||||||||||||
Title : | Crystal Structure of beta secetase in complex with (6S)-2-amino-3,6-dimethyl-6-[(1R,2R)-2-phenylcyclopropyl]-3,4,5,6-tetrahydropyrimidin-4-one | ||||||||||||
Release Data : | 2013-10-02 | ||||||||||||
Compound : |
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Source : |
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Authors : | Yonezawa, S., Fujiwara, K., Yamamoto, T., Hattori, K., Yamakawa, H., Muto, C., Hosono, M., Tanaka, Y., Nakano, T., Takemoto, H., Arisawa, M., Shuto, S. | ||||||||||||
Keywords : | PROTEASE 2, ASP2, MEMBRANE-ASSOCIATED ASPARTIC PROTEASE 2, MEMAPSIN-2, Hydrolase | ||||||||||||
Exp. method : | X-RAY DIFFRACTION ( 2.5010 Å ) | ||||||||||||
Citation : |
Conformational restriction approach to beta-secretase (BACE1) inhibitors III: Effective investigation of the binding mode by combinational use of X-ray analysis, isothermal titration calorimetry and theoretical calculations
Yonezawa, S.,Fujiwara, K.,Yamamoto, T.
et al.
PubMed: 24051074 |
Reaction
Chain : | A | ||||||||
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UniProt : | P56817 (BACE1_HUMAN) | ||||||||
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