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Structure paper

TitleRecognition of Smac-mimetic compounds by the BIR domain of cIAP1
Journal, issue, pagesProtein Sci., Vol. 19, Page 2418-2429, Year 2010
Publish dateMay 3, 2010 (structure data deposition date)
AuthorsCossu, F. / Malvezzi, F. / Canevari, G. / Mastrangelo, E. / Lecis, D. / Delia, D. / Seneci, P. / Scolastico, C. / Bolognesi, M. / Milani, M.
External linksProtein Sci. / PubMed:20954235
MethodsX-ray diffraction
Resolution2.6 - 3 Å
Structure data

PDB-3mup:
cIAP1-BIR3 domain in complex with the Smac-mimetic compound Smac037
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

PDB-3oz1:
cIAP1-BIR3 domain in complex with the Smac-mimetic compound Smac066
Method: X-RAY DIFFRACTION / Resolution: 3 Å

Chemicals

ChemComp-SMK:
(3S,6S,7R,9aS)-6-{[(2S)-2-aminobutanoyl]amino}-7-(2-aminoethyl)-N-(diphenylmethyl)-5-oxooctahydro-1H-pyrrolo[1,2-a]azepine-3-carboxamide

ChemComp-ZN:
Unknown entry

ChemComp-HOH:
WATER

ChemComp-BMB:
(3S,6S,7R,9aS)-7-[2-(benzylamino)ethyl]-N-(diphenylmethyl)-6-{[(2S)-2-(methylamino)butanoyl]amino}-5-oxooctahydro-1H-pyrrolo[1,2-a]azepine-3-carboxamide

Source
  • homo sapiens (human)
KeywordsAPOPTOSIS INHIBITOR / Zinc-Finger motif / Zinc-finger / Caspases

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