3V04

Discovery of Novel Allosteric MEK Inhibitors Possessing Classical and Non-classical Bidentate Ser212 Interactions.

3V04 の概要

• エントリーDOI: 10.2210/pdb3v04/pdb
• 関連するPDBエントリー: 3V01
• 分子名称: Dual specificity mitogen-activated protein kinase kinase 1, 4-[(2-fluoro-4-iodophenyl)amino]-N-(2-hydroxyethoxy)-1H-indazole-5-carboxamide, ADENOSINE-5'-TRIPHOSPHATE, ... (4 entities in total)
• 機能のキーワード: kinase, transferase-inhibitor complex, transferase/inhibitor
• 由来する生物種: Homo sapiens (human)
• 細胞内の位置: Cytoplasm, cytoskeleton, centrosome: Q02750
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 38918.30

構造登録者

Heald, R.,Jackson, P.,Savy, P.,Jones, M.,Gancia, E.,Burton, B.,Newman, R.,Boggs, J.,Chan, E.,Chan, J.,Choo, E.,Merchant, M.,Ultsch, M.,Wiesmann, C.,Belvin, M.,Price, S. (登録日: 2011-12-07, 公開日: 2012-05-09, 最終更新日: 2023-09-13)

• 主引用文献: Heald, R.A.,Jackson, P.,Savy, P.,Jones, M.,Gancia, E.,Burton, B.,Newman, R.,Boggs, J.,Chan, E.,Chan, J.,Choo, E.,Merchant, M.,Rudewicz, P.,Ultsch, M.,Wiesmann, C.,Yue, Q.,Belvin, M.,Price, S.; Discovery of Novel Allosteric Mitogen-Activated Protein Kinase Kinase (MEK) 1,2 Inhibitors Possessing Bidentate Ser212 Interactions.; J.Med.Chem., 55:4594-4604, 2012; PubMed: 22506516; DOI: 10.1021/jm2017094

実験手法

X-RAY DIFFRACTION (2.7 Å)