4V25

VER-246608, a novel pan-isoform ATP competitive inhibitor of pyruvate dehydrogenase kinase, disrupts Warburg metabolism and induces context- dependent cytostasis in cancer cells

4V25 の概要

• エントリーDOI: 10.2210/pdb4v25/pdb
• 関連するPDBエントリー: 4V26
• 分子名称: [PYRUVATE DEHYDROGENASE (ACETYL-TRANSFERRING)] KINASE ISOZYME 2, MITOCHONDRIAL, N-(2-AMINOETHYL)-2-{3-CHLORO-4-[(4-ISOPROPYLBENZYL)OXY]PHENYL} ACETAMIDE, MAGNESIUM ION, ... (5 entities in total)
• 機能のキーワード: transferase, glycolysis, warburg metabolism, nov3r
• 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: 47228.87

構造登録者

Moore, J.D.,Staniszewska, A.,Shaw, T.,D'Alessandro, J.,Davis, B.,Surgenor, A.,Baker, L.,Matassova, N.,Murray, J.,Macias, A.,Brough, P.,Wood, M.,Mahon, P.C. (登録日: 2014-10-06, 公開日: 2014-12-03, 最終更新日: 2024-05-01)

• 主引用文献: Moore, J.D.,Staniszewska, A.,Shaw, T.,D'Alessandro, J.,Davis, B.,Surgenor, A.,Baker, L.,Matassova, N.,Murray, J.,Macias, A.,Brough, P.,Wood, M.,Mahon, P.C.; VER-246608, a novel pan-isoform ATP competitive inhibitor of pyruvate dehydrogenase kinase, disrupts Warburg metabolism and induces context-dependent cytostasis in cancer cells.; Oncotarget, 5:12862-12876, 2014; PubMed: 25404640; DOI: 10.18632/oncotarget.2656

実験手法

X-RAY DIFFRACTION (2.6 Å)