6U6F

The crystal structure of anti-apoptotic Mcl-1 protein in complex with 2, 5-substituted benzoic acid inhibitor 21

6U6F の概要

• エントリーDOI: 10.2210/pdb6u6f/pdb
• 関連するPDBエントリー: 6U63 6U64 6U65 6U67
• 分子名称: Induced myeloid leukemia cell differentiation protein Mcl-1, 2-[({4-[(4-tert-butylphenyl)methyl]piperazin-1-yl}sulfonyl)amino]-5-[(2-phenylethyl)sulfanyl]benzoic acid (3 entities in total)
• 機能のキーワード: apoptosis, mcl1, bfl1/a1, protein-protein interaction, bh3 mimetics, cancer, apoptosis-inhibitor complex, apoptosis/inhibitor
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 3
• 化学式量合計: 55785.74

構造登録者

Yang, Y.,Stuckey, J.A.,Nikolovska-Coleska, Z. (登録日: 2019-08-29, 公開日: 2020-03-04, 最終更新日: 2023-10-11)

• 主引用文献: Kump, K.J.,Miao, L.,Mady, A.S.A.,Ansari, N.H.,Shrestha, U.K.,Yang, Y.,Pal, M.,Liao, C.,Perdih, A.,Abulwerdi, F.A.,Chinnaswamy, K.,Meagher, J.L.,Carlson, J.M.,Khanna, M.,Stuckey, J.A.,Nikolovska-Coleska, Z.; Discovery and Characterization of 2,5-Substituted Benzoic Acid Dual Inhibitors of the Anti-apoptotic Mcl-1 and Bfl-1 Proteins.; J.Med.Chem., 63:2489-2510, 2020; PubMed: 31971799; DOI: 10.1021/acs.jmedchem.9b01442

実験手法

X-RAY DIFFRACTION (2.9 Å)