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TitleStructure-Based Design, Synthesis, Evaluation, and Crystallographic Studies of Conformationally Constrained Smac Mimetics as Inhibitors of the X-Linked Inhibitor of Apoptosis Protein (Xiap).
Journal, issue, pagesJ. Med. Chem., Vol. 51, Page 7169-, Year 2008
Publish dateAug 21, 2008 (structure data deposition date)
AuthorsSun, H. / Stuckey, J.A. / Nikolovska-Coleska, Z. / Qin, D. / Meagher, J.L. / Qiu, S. / Lu, J. / Yang, C. / Saito, N.G. / Wang, S.
External linksJ. Med. Chem. / PubMed:18954041
MethodsX-ray diffraction
Resolution2.82 Å
Structure data

PDB-2jk7:
XIAP BIR3 bound to a Smac Mimetic
Method: X-RAY DIFFRACTION / Resolution: 2.82 Å

Chemicals

ChemComp-BI6:
(3S,6S,7Z,10AS)-N-(DIPHENYLMETHYL)-6-{[(2S)-2-(METHYLIDENEAMINO)BUTANOYL]AMINO}-5-OXO-1,2,3,5,6,9,10,10A-OCTAHYDROPYRROLO[1,2-A]AZOCINE-3-CARBOXAMIDE

ChemComp-ZN:
Unknown entry

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsAPOPTOSIS / ZINC-FINGER / POLYMORPHISM / SMAC MIMETIC / METAL-BINDING / BIR3 / ZINC / LIGASE / CYTOPLASM / X-LINKED INHIBITOR OF APOPTOSIS / UBL CONJUGATION PATHWAY / THIOL PROTEASE INHIBITOR / PHOSPHOPROTEIN / UBL CONJUGATION / PROTEASE INHIBITOR

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