7LHB

Crystal structure of Bcl-2 in complex with prodrug ABBV-167

7LHB の概要

• エントリーDOI: 10.2210/pdb7lhb/pdb
• 分子名称: Apoptosis regulator Bcl-2, Phosphoric acid mono-[5-(5-{4-[2-(4-chloro-phenyl)-4,4-dimethyl-cyclohex-1-enylmethyl]-piperazin-1-yl}-2-{3-nitro-4-[(tetrahydro-pyran-4-ylmethyl)-amino]-benzenesulfonylaminocarbonyl}-phenoxy)-pyrrolo[2,3-b]pyridin-7-ylmethyl] ester (3 entities in total)
• 機能のキーワード: bcl-2, apoptosis, prodrug, abbv-167
• 由来する生物種: Homo sapiens (Human); 詳細
• タンパク質・核酸の鎖数: 3
• 化学式量合計: 61002.08

構造登録者

Judge, R.A.,Salem, A.H. (登録日: 2021-01-21, 公開日: 2021-04-14, 最終更新日: 2023-10-18)

• 主引用文献: Salem, A.H.,Tao, Z.F.,Bueno, O.F.,Chen, J.,Chen, S.,Edalji, R.,Elmore, S.W.,Fournier, K.M.,Harper, K.C.,Hong, R.,Jenkins, G.J.,Ji, J.,Judge, R.A.,Kalvass, J.C.,Klix, R.C.,Ku, Y.Y.,Leverson, J.D.,Marks, R.A.,Marsh, K.C.,Menon, R.M.,Park, C.H.,Phillips, D.C.,Pu, Y.M.,Rosenberg, S.H.,Sanzgiri, Y.D.,Sheikh, A.Y.,Shi, Y.,Stolarik, D.,Suleiman, A.A.,Wang, X.,Zhang, G.G.Z.,Catron, N.D.,Souers, A.J.; Expanding the Repertoire for "Large Small Molecules": Prodrug ABBV-167 Efficiently Converts to Venetoclax with Reduced Food Effect in Healthy Volunteers.; Mol.Cancer Ther., 20:999-1008, 2021; PubMed: 33785651; DOI: 10.1158/1535-7163.MCT-21-0077

実験手法

X-RAY DIFFRACTION (2.068 Å)