Structural, Biochemical, and Computational Characterization of Sulfamides as Bimetallic Peptidase Inhibitors

The sulfonamide function is used extensively as a general building block in various inhibitory scaffolds and, more specifically, as a zinc-binding group (ZBG) of metalloenzyme inhibitors. Here, we provide biochemical, structural, and computational characterization of a metallopeptidase in complex wi...

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Veröffentlicht in:	Journal of chemical information and modeling 2024-02, Vol.64 (3), p.1030-1042
Hauptverfasser:	Novakova, Zora, Tehrani, Zahra Aliakbar, Jurok, Radek, Motlova, Lucia, Kutil, Zsofia, Pavlicek, Jiri, Shukla, Shivam, Choy, Cindy J., Havlinova, Barbora, Baranova, Petra, Berkman, Clifford E., Kuchar, Martin, Cerny, Jiri, Barinka, Cyril
Format:	Artikel
Sprache:	eng
Schlagworte:	Bimetals Binding Enzymes Inhibitors Ions Mathematical analysis Metalloproteins - chemistry Pharmaceutical Modeling Protease Inhibitors - pharmacology Quantum mechanics Reaction intermediates Structural analysis Sulfonamides Zinc Zinc - metabolism
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