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TitleRedirecting the Peptide Cleavage Causes Protease Inactivation.
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 64, Page e202506832-e202506832, Year 2025
Publish dateSep 21, 2022 (structure data deposition date)
AuthorsBreuer, C. / Kuppers, J. / Schulz-Fincke, A.C. / Heilos, A. / Lemke, C. / Spiwokova, P. / Schmitz, J. / Cremer, L. / Frigole-Vivas, M. / Lulsdorff, M. ...Breuer, C. / Kuppers, J. / Schulz-Fincke, A.C. / Heilos, A. / Lemke, C. / Spiwokova, P. / Schmitz, J. / Cremer, L. / Frigole-Vivas, M. / Lulsdorff, M. / Mertens, M.D. / Wichterle, F. / Apeltauer, M. / Horn, M. / Gilberg, E. / Furtmann, N. / Bajorath, J. / Bartz, U. / Engels, B. / Mares, M. / Gutschow, M.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:40394881
MethodsX-ray diffraction
Resolution1.45 - 1.7 Å
Structure data

PDB-8b4t:
Human cathepsin B in complex with the carbamate inhibitor 7
Method: X-RAY DIFFRACTION / Resolution: 1.45 Å

PDB-8b5f:
Human cathepsin B in complex with the carbamate inhibitor 31
Method: X-RAY DIFFRACTION / Resolution: 1.7 Å

Chemicals

ChemComp-P9F:
(2S)-2-[[(2S)-2-[(4-chloranylphenoxy)carbonylamino]-3-cyclohexyl-propanoyl]amino]-3-phenyl-propanoic acid

ChemComp-HOH:
WATER

ChemComp-P9U:
(2S)-2-[[(2S)-2-[[3-chloranyl-4-[[3-phenyl-2-(phenylmethyl)propanoyl]amino]phenoxy]carbonylamino]-3-cyclohexyl-propanoyl]amino]-3-phenyl-propanoic acid

ChemComp-EDO:
1,2-ETHANEDIOL

Source
  • homo sapiens (human)
KeywordsHYDROLASE / Cathepsin B Cysteine cathepsin Inhibitor Carbamate Peptidomimetic Cysteine proteinases / Cathepsin B / Cysteine cathepsin / Inhibitor / Carbamate / Peptidomimetic Cysteine proteinases

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