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TitleThe role of the acidity of N-heteroaryl sulfonamides as inhibitors of bcl-2 family protein-protein interactions.
Journal, issue, pagesACS Med Chem Lett, Vol. 4, Page 186-190, Year 2013
Publish dateDec 13, 2012 (structure data deposition date)
AuthorsToure, B.B. / Miller-Moslin, K. / Yusuff, N. / Perez, L. / Dore, M. / Joud, C. / Michael, W. / DiPietro, L. / van der Plas, S. / McEwan, M. ...Toure, B.B. / Miller-Moslin, K. / Yusuff, N. / Perez, L. / Dore, M. / Joud, C. / Michael, W. / DiPietro, L. / van der Plas, S. / McEwan, M. / Lenoir, F. / Hoe, M. / Karki, R. / Springer, C. / Sullivan, J. / Levine, K. / Fiorilla, C. / Xie, X. / Kulathila, R. / Herlihy, K. / Porter, D. / Visser, M.
External linksACS Med Chem Lett / PubMed:24900652
MethodsX-ray diffraction
Resolution2.1 Å
Structure data

PDB-4ieh:
Crystal Structure of human Bcl-2 in complex with a small molecule inhibitor targeting Bcl-2 BH3 domain interactions
Method: X-RAY DIFFRACTION / Resolution: 2.1 Å

Chemicals

ChemComp-1E9:
N-(6-{4-[(4'-chlorobiphenyl-2-yl)methyl]piperazin-1-yl}-1,1-dioxido-1,2-benzothiazol-3-yl)-4-{[(2R)-4-(dimethylamino)-1-(phenylsulfanyl)butan-2-yl]amino}-3-nitrobenzenesulfonamide

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsAPOPTOSIS/INHIBITOR / protein-protein interaction / alpha helical / pro-apoptosis / cytochrome c release / caspase activation / BIM / BAK / BAD / PUMA / APOPTOSIS-INHIBITOR complex

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