Exploring benzoxaborole derivatives as carbonic anhydrase inhibitors: a structural and computational analysis reveals their conformational variability as a tool to increase enzyme selectivity

Recent studies identified the benzoxaborole moiety as a new zinc-binding group able to interact with carbonic anhydrase (CA) active site. Here, we report a structural analysis of benzoxaboroles containing urea/thiourea groups, showing that these molecules are very versatile since they can bind the e...

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Veröffentlicht in:J Enzyme Inhib Med Chem
Hauptverfasser: Langella, Emma, Alterio, Vincenzo, D’Ambrosio, Katia, Cadoni, Roberta, Winum, Jean-Yves, Supuran, Claudiu T., Monti, Simona Maria, De Simone, Giuseppina, Di Fiore, Anna
Format: Artigo
Sprache:Inglês
Veröffentlicht: Taylor & Francis 2019
Schlagworte:
Research Paper
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC6713116/
https://ncbi.nlm.nih.gov/pubmed/31423863
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1080/14756366.2019.1653291
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