4TUH

Bcl-xL in complex with inhibitor (Compound 10)

Summary for 4TUH

• Entry DOI: 10.2210/pdb4tuh/pdb
• Descriptor: Bcl-2-like protein 1, 2-[8-(1,3-benzothiazol-2-ylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl]-5-{3-[4-(1H-pyrazolo[3,4-d]pyrimidin-1-yl)phenoxy]propyl}-1,3-thiazole-4-carboxylic acid, 1,2-ETHANEDIOL, ... (5 entities in total)
• Functional Keywords: apoptosis, drug design
• Biological source: Homo sapiens (Human); More
• Cellular location: Isoform Bcl-X(L): Mitochondrion inner membrane : Q07817
• Total number of polymer chains: 8
• Total formula weight: 149781.89

Authors

Czabotar, P.E.,Lessense, G.,Smith, B.J.,Colman, P.M. (deposition date: 2014-06-24, release date: 2014-10-15, Last modification date: 2023-12-27)

• Primary citation: Koehler, M.F.,Bergeron, P.,Choo, E.F.,Lau, K.,Ndubaku, C.,Dudley, D.,Gibbons, P.,Sleebs, B.E.,Rye, C.S.,Nikolakopoulos, G.,Bui, C.,Kulasegaram, S.,Kersten, W.J.,Smith, B.J.,Czabotar, P.E.,Colman, P.M.,Huang, D.C.,Baell, J.B.,Watson, K.G.,Hasvold, L.,Tao, Z.F.,Wang, L.,Souers, A.J.,Elmore, S.W.,Flygare, J.A.,Fairbrother, W.J.,Lessene, G.; Structure-Guided Rescaffolding of Selective Antagonists of BCL-XL.; Acs Med.Chem.Lett., 5:662-667, 2014; PubMed: 24944740; DOI: 10.1021/ml500030p

Experimental method

X-RAY DIFFRACTION (1.8 Å)