6BQK
CRYSTAL STRUCTURE OF HEPATIS C VIRUS PROTEASE (NS3) COMPLEXED WITH TRIPEPTIDIC ACYL SULFONAMIDE INHIBITOR (COMPOUND 18)
6BQK の概要
エントリーDOI | 10.2210/pdb6bqk/pdb |
分子名称 | NS3 protease, N-(tert-butoxycarbonyl)-3-methyl-L-valyl-(4R)-4-[(7-chloro-4-methoxyisoquinolin-1-yl)oxy]-N-[(1R,2R)-1-[(cyclopropylsulfonyl)carbamoyl]-2-(difluoromethyl)cyclopropyl]-L-prolinamide, ZINC ION, ... (4 entities in total) |
機能のキーワード | serine protease, viral protein, hydrolase |
由来する生物種 | Hepatitis C virus |
タンパク質・核酸の鎖数 | 2 |
化学式量合計 | 48197.96 |
構造登録者 | |
主引用文献 | Zheng, B.,D'Andrea, S.V.,Sun, L.Q.,Wang, A.X.,Chen, Y.,Hrnciar, P.,Friborg, J.,Falk, P.,Hernandez, D.,Yu, F.,Sheaffer, A.K.,Knipe, J.O.,Mosure, K.,Rajamani, R.,Good, A.C.,Kish, K.,Tredup, J.,Klei, H.E.,Paruchuri, M.,Ng, A.,Gao, Q.,Rampulla, R.A.,Mathur, A.,Meanwell, N.A.,McPhee, F.,Scola, P.M. Potent Inhibitors of Hepatitis C Virus NS3 Protease: Employment of a Difluoromethyl Group as a Hydrogen-Bond Donor. ACS Med Chem Lett, 9:143-148, 2018 Cited by PubMed: 29456803DOI: 10.1021/acsmedchemlett.7b00503 主引用文献が同じPDBエントリー |
実験手法 | X-RAY DIFFRACTION (1.97 Å) |
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