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TitleBraces for the Peptide Backbone: Insights Into Structure-Activity Relation-Ships of Protease Inhibitor Mimics with Locked Amide Conformations
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 51, Page 3708-, Year 2012
Publish dateDec 8, 2011 (structure data deposition date)
AuthorsTischler, M. / Nasu, D. / Empting, M. / Schmelz, S. / Heinz, D. / Rottmann, P. / Kolmar, H. / Buntkowsky, G. / Tietze, D. / Avrutina, O.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:22374650
MethodsX-ray diffraction
Resolution1.45 - 1.55 Å
Structure data

PDB-4abi:
Co-complex structure of bovine trypsin with a modified Bowman-Birk inhibitor (PtA)SFTI-1(1,14), that was 1,4-disubstituted with a 1,2,3- trizol to mimic a trans amide bond
Method: X-RAY DIFFRACTION / Resolution: 1.55 Å

PDB-4abj:
Co-complex structure of bovine trypsin with a modified Bowman-Birk inhibitor (IcA)SFTI-1(1,14), that was 1,5-disubstituted with 1,2,3- trizol to mimic a cis amide bond
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

Chemicals

ChemComp-CA:
Unknown entry

ChemComp-DMF:
DIMETHYLFORMAMIDE

ChemComp-GOL:
GLYCEROL

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

Source
  • bos taurus (domestic cattle)
  • synthetic construct (others)
  • helianthus annuus (common sunflower)
KeywordsHYDROLASE/INHIBITOR / HYDROLASE-INHIBITOR COMPLEX / AMIDE MIMICS

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