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3U4O

Novel HCV NS5B polymerase Inhibitors: Discovery of Indole C2 Acyl sulfonamides

3U4O の概要
エントリーDOI10.2210/pdb3u4o/pdb
関連するPDBエントリー3U4R
分子名称RNA-directed RNA polymerase, 1-[(2-aminopyridin-4-yl)methyl]-5-chloro-3-(2-oxo-1,2-dihydropyridin-3-yl)-1H-indole-2-carboxylic acid, PHOSPHATE ION, ... (4 entities in total)
機能のキーワードnucleotidyl transfer, transferase-transferase inhibitor complex, transferase/transferase inhibitor
由来する生物種Hepatitis C virus (HCV)
細胞内の位置Core protein p21: Host endoplasmic reticulum membrane; Single-pass membrane protein (By similarity). Core protein p19: Virion (By similarity). Envelope glycoprotein E1: Virion membrane; Single-pass type I membrane protein (Potential). Envelope glycoprotein E2: Virion membrane; Single-pass type I membrane protein (Potential). p7: Host endoplasmic reticulum membrane; Multi-pass membrane protein (By similarity). Protease NS2-3: Host endoplasmic reticulum membrane; Multi-pass membrane protein (Potential). Serine protease NS3: Host endoplasmic reticulum membrane; Peripheral membrane protein (By similarity). Non-structural protein 4A: Host endoplasmic reticulum membrane; Single-pass type I membrane protein (Potential). Non-structural protein 4B: Host endoplasmic reticulum membrane; Multi-pass membrane protein (By similarity). Non-structural protein 5A: Host endoplasmic reticulum membrane; Peripheral membrane protein (By similarity). RNA-directed RNA polymerase: Host endoplasmic reticulum membrane; Single-pass type I membrane protein (Potential): O92972
タンパク質・核酸の鎖数2
化学式量合計129820.40
構造登録者
主引用文献Anilkumar, G.N.,Selyutin, O.,Rosenblum, S.B.,Zeng, Q.,Jiang, Y.,Chan, T.Y.,Pu, H.,Wang, L.,Bennett, F.,Chen, K.X.,Lesburg, C.A.,Duca, J.,Gavalas, S.,Huang, Y.,Pinto, P.,Sannigrahi, M.,Velazquez, F.,Venkatraman, S.,Vibulbhan, B.,Agrawal, S.,Ferrari, E.,Jiang, C.K.,Huang, H.C.,Shih, N.Y.,George Njoroge, F.,Kozlowski, J.A.
II. Novel HCV NS5B polymerase inhibitors: Discovery of indole C2 acyl sulfonamides.
Bioorg.Med.Chem.Lett., 22:713-717, 2012
Cited by
PubMed: 22104146
DOI: 10.1016/j.bmcl.2011.10.041
主引用文献が同じPDBエントリー
実験手法
X-RAY DIFFRACTION (1.77 Å)
構造検証レポート
Validation report summary of 3u4o
検証レポート(詳細版)ダウンロードをダウンロード

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件を2024-03-27に公開中

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