8CEQ

Crystal structure of monkeypox virus methyltransferase VP39 in complex with inhibitor TO427

8CEQ の概要

• エントリーDOI: 10.2210/pdb8ceq/pdb
• 分子名称: Cap-specific mRNA (nucleoside-2'-O-)-methyltransferase, (2~{S})-2-azanyl-4-[[(2~{S},3~{S},4~{R},5~{R})-5-[4-azanyl-5-(2-phenylethynyl)pyrrolo[2,3-d]pyrimidin-7-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methylsulfanyl]butanoic acid (3 entities in total)
• 機能のキーワード: viral, methyltransferase, vp39, monkeypox, mpox, capping, enzyme, inhibitor, viral protein
• 由来する生物種: Monkeypox virus
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 72866.06

構造登録者

Klima, M.,Silhan, J.,Boura, E. (登録日: 2023-02-02, 公開日: 2023-04-05, 最終更新日: 2024-06-19)

• 主引用文献: Silhan, J.,Klima, M.,Otava, T.,Skvara, P.,Chalupska, D.,Chalupsky, K.,Kozic, J.,Nencka, R.,Boura, E.; Discovery and structural characterization of monkeypox virus methyltransferase VP39 inhibitors reveal similarities to SARS-CoV-2 nsp14 methyltransferase.; Nat Commun, 14:2259-2259, 2023; PubMed: 37080993; DOI: 10.1038/s41467-023-38019-1

実験手法

X-RAY DIFFRACTION (2.5 Å)