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3H98

Crystal structure of HCV NS5b 1b with (1,1-dioxo-2H-[1,2,4]benzothiadiazin-3-yl) azolo[1,5-a]pyrimidine derivative

3H98 の概要
エントリーDOI10.2210/pdb3h98/pdb
分子名称RNA-directed RNA polymerase, N-{3-[5-hydroxy-8-(3-methylbutyl)-7-oxo-7,8-dihydroimidazo[1,2-a]pyrimidin-6-yl]-1,1-dioxido-4H-1,2,4-benzothiadiazin-7-yl}methanesulfonamide, GLYCEROL, ... (4 entities in total)
機能のキーワードrna polymerase, nucleotide binding, transferase
由来する生物種Hepatitis C virus (isolate BK) (HCV)
細胞内の位置Core protein p21: Host endoplasmic reticulum membrane; Single-pass membrane protein. 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): P26663
タンパク質・核酸の鎖数2
化学式量合計129526.58
構造登録者
主引用文献Wang, G.,Lei, H.,Wang, X.,Das, D.,Hong, J.,Mackinnon, C.H.,Coulter, T.S.,Montalbetti, C.A.,Mears, R.,Gai, X.,Bailey, S.E.,Ruhrmund, D.,Hooi, L.,Misialek, S.,Rajagopalan, P.T.,Cheng, R.K.,Barker, J.J.,Felicetti, B.,Schonfeld, D.L.,Stoycheva, A.,Buckman, B.O.,Kossen, K.,Seiwert, S.D.,Beigelman, L.
HCV NS5B polymerase inhibitors 2: Synthesis and in vitro activity of (1,1-dioxo-2H-[1,2,4]benzothiadiazin-3-yl) azolo[1,5-a]pyridine and azolo[1,5-a]pyrimidine derivatives.
Bioorg.Med.Chem.Lett., 19:4480-4483, 2009
Cited by
PubMed: 19500983
DOI: 10.1016/j.bmcl.2009.05.022
主引用文献が同じPDBエントリー
実験手法
X-RAY DIFFRACTION (1.9 Å)
構造検証レポート
Validation report summary of 3h98
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2024-04-24に公開中

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