2O2F

Solution structure of the anti-apoptotic protein Bcl-2 in complex with an acyl-sulfonamide-based ligand

Summary for 2O2F

• Entry DOI: 10.2210/pdb2o2f/pdb
• Related: 2O1Y 2O21 2O22
• Descriptor: Apoptosis regulator Bcl-2, 4-(4-BENZYL-4-METHOXYPIPERIDIN-1-YL)-N-[(4-{[1,1-DIMETHYL-2-(PHENYLTHIO)ETHYL]AMINO}-3-NITROPHENYL)SULFONYL]BENZAMIDE (2 entities in total)
• Functional Keywords: apoptosis, complex, bcl
• Biological source: Homo sapiens (human)
• Cellular location: Mitochondrion outer membrane; Single-pass membrane protein: P10415
• Total number of polymer chains: 1
• Total formula weight: 17055.26

Authors

Bruncko, M.,Oost, T.K.,Belli, B.A.,Ding, H.,Joseph, M.K.,Kunzer, A.,Martineau, D.,McClellan, W.J.,Mitten, M.,Ng, S.C.,Nimmer, P.M.,Oltersdorf, T.,Park, C.M.,Petros, A.M.,Shoemaker, A.R.,Song, X.,Wang, X.,Wendt, M.D.,Zhang, H.,Fesik, S.W.,Rosenberg, S.H.,Elmore, S.W. (deposition date: 2006-11-29, release date: 2007-02-27, Last modification date: 2023-12-27)

• Primary citation: Bruncko, M.,Oost, T.K.,Belli, B.A.,Ding, H.,Joseph, M.K.,Kunzer, A.,Martineau, D.,McClellan, W.J.,Mitten, M.,Ng, S.C.,Nimmer, P.M.,Oltersdorf, T.,Park, C.M.,Petros, A.M.,Shoemaker, A.R.,Song, X.,Wang, X.,Wendt, M.D.,Zhang, H.,Fesik, S.W.,Rosenberg, S.H.,Elmore, S.W.; Studies Leading to Potent, Dual Inhibitors of Bcl-2 and Bcl-xL.; J.Med.Chem., 50:641-662, 2007; PubMed: 17256834; DOI: 10.1021/jm061152t

Experimental method

SOLUTION NMR