8AO3

Specific covalent inhibitor of ERK2

8AO3 の概要

• エントリーDOI: 10.2210/pdb8ao3/pdb
• 分子名称: Mitogen-activated protein kinase 1, SULFATE ION, 2-chloranyl-~{N}-(1~{H}-indazol-5-ylmethyl)ethanamide, ... (4 entities in total)
• 機能のキーワード: serine-threonine kinase, transcriptional repressor, cell cycle, atp binding, signaling protein
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 43043.82

構造登録者

Cleasby, A. (登録日: 2022-08-08, 公開日: 2022-09-28, 最終更新日: 2022-10-05)

• 主引用文献: St Denis, J.D.,Chessari, G.,Cleasby, A.,Cons, B.D.,Cowan, S.,Dalton, S.E.,East, C.,Murray, C.W.,O'Reilly, M.,Peakman, T.,Rapti, M.,Stow, J.L.; X-ray Screening of an Electrophilic Fragment Library and Application toward the Development of a Novel ERK 1/2 Covalent Inhibitor.; J.Med.Chem., 65:12319-12333, 2022; PubMed: 36101934; DOI: 10.1021/acs.jmedchem.2c01044

実験手法

X-RAY DIFFRACTION (1.778 Å)