5EHI

DENGUE 3 NS5 METHYLTRANSFERASE BOUND TO S-ADENOSYL METHIONINE AND MOLECULE BF287

5EHI の概要

• エントリーDOI: 10.2210/pdb5ehi/pdb
• 分子名称: NS5 methyltransferase dengue virus, S-ADENOSYLMETHIONINE, 4-[[3-[(2-azanyl-4-chloranyl-phenyl)carbamoylamino]phenyl]sulfonylamino]benzoic acid, ... (4 entities in total)
• 機能のキーワード: transferase, dengue virus, ns5 methyltransferase, fragment-based drug discovery
• 由来する生物種: Dengue virus type 3 (strain Philippines/H87/1956) (DENV-3)
• 細胞内の位置: Protein C: Virion . Peptide pr: Secreted . Small envelope protein M: Virion membrane ; Multi-pass membrane protein . Envelope protein E: Virion membrane ; Multi-pass membrane protein . Non-structural protein 1: Secreted . Non-structural protein 2A-alpha: Host endoplasmic reticulum membrane ; Multi-pass membrane protein . Non-structural protein 2A: Host endoplasmic reticulum membrane ; Multi- pass membrane protein . Serine protease subunit NS2B: Host endoplasmic reticulum membrane ; Peripheral membrane protein ; Cytoplasmic side . Serine protease NS3: Host endoplasmic reticulum membrane ; Peripheral membrane protein ; Cytoplasmic side . Non-structural protein 4A: Host endoplasmic reticulum membrane ; Multi- pass membrane protein . Non-structural protein 4B: Host endoplasmic reticulum membrane ; Multi- pass membrane protein . RNA-directed RNA polymerase NS5: Host endoplasmic reticulum membrane ; Peripheral membrane protein ; Cytoplasmic side : P27915
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 63671.39

構造登録者

Barral, K.,Bricogne, G.,Sharff, A. (登録日: 2015-10-28, 公開日: 2016-10-26, 最終更新日: 2024-01-10)

• 主引用文献: Benmansour, F.,Trist, I.,Coutard, B.,Decroly, E.,Querat, G.,Brancale, A.,Barral, K.; Discovery of novel dengue virus NS5 methyltransferase non-nucleoside inhibitors by fragment-based drug design.; Eur.J.Med.Chem., 125:865-880, 2016; PubMed: 27750202; DOI: 10.1016/j.ejmech.2016.10.007

実験手法

X-RAY DIFFRACTION (1.303 Å)