5C5N
Structure of SARS-3CL protease complex with a phenyl-beta-alanyl (R,S)-N-decalin type inhibitor
Summary for 5C5N
Entry DOI | 10.2210/pdb5c5n/pdb |
Related | 5C5O |
Descriptor | 3C-like proteinase, (2S)-3-(1H-imidazol-5-yl)-2-({[(3R,4aS,8aR)-2-(N-phenyl-beta-alanyl)decahydroisoquinolin-3-yl]methyl}amino)propanal (3 entities in total) |
Functional Keywords | hydrase proteinase converting, designed inhibitor, hydrase-inhibitor complex, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Human SARS coronavirus (SARS-CoV) |
Total number of polymer chains | 1 |
Total formula weight | 34270.18 |
Authors | Akaji, K.,Teruya, K.,Shimamoto, Y.,Sanjho, A.,Yamashita, E.,Nakagawa, A. (deposition date: 2015-06-21, release date: 2016-06-22, Last modification date: 2020-01-29) |
Primary citation | Shimamoto, Y.,Hattori, H.,Kobayashi, K.,Teruya, K.,Sanjho, A.,Nakagawa, A.,Yamashita, E.,Akaji, K. Fused-ring structure of N-decalin as a novel scaffold for SARS 3CL protease inhibitors to be published, |
Experimental method | X-RAY DIFFRACTION (1.69 Å) |
Structure validation
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