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TitleASTX660, a Novel Non-peptidomimetic Antagonist of cIAP1/2 and XIAP, Potently Induces TNF alpha-Dependent Apoptosis in Cancer Cell Lines and Inhibits Tumor Growth.
Journal, issue, pagesMol. Cancer Ther., Vol. 17, Page 1381-1391, Year 2018
Publish dateAug 14, 2017 (structure data deposition date)
AuthorsWard, G.A. / Lewis, E.J. / Ahn, J.S. / Johnson, C.N. / Lyons, J.F. / Martins, V. / Munck, J.M. / Rich, S.J. / Smyth, T. / Thompson, N.T. ...Ward, G.A. / Lewis, E.J. / Ahn, J.S. / Johnson, C.N. / Lyons, J.F. / Martins, V. / Munck, J.M. / Rich, S.J. / Smyth, T. / Thompson, N.T. / Williams, P.A. / Wilsher, N.E. / Wallis, N.G. / Chessari, G.
External linksMol. Cancer Ther. / PubMed:29695633
MethodsX-ray diffraction
Resolution2.31 Å
Structure data

PDB-5oqw:
XIAP in complex with small molecule
Method: X-RAY DIFFRACTION / Resolution: 2.31 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-NA:
Unknown entry

ChemComp-A4E:
1-[6-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-3,3-dimethyl-2~{H}-pyrrolo[3,2-b]pyridin-1-yl]-2-[(2~{R},5~{R})-5-methyl-2-[[(3~{R})-3-methylmorpholin-4-yl]methyl]piperazin-4-ium-1-yl]ethanone

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsAPOPTOSIS / XIAP / Protease inhibitor / Apoptosis regulation

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