A Combined Crystallographic and Theoretical Study Explains the Capability of Carboxylic Acids to Adopt Multiple Binding Modes in the Active Site of Carbonic Anhydrases
Articolo
Data di Pubblicazione:
2016
Abstract:
Carboxylates are the least investigated class of inhibitors of carbonic anhydrases (CAs). Here we explain the versatility of binding of these molecules to CAs by examining a new adduct of hCA II with N-carboxymethylsaccharin.
Tipologia CRIS:
01.01 Articolo in rivista
Keywords:
carbonic anhydrases; drug design; inhibitors; theoretical calculations; X-ray structures
Elenco autori:
DE SIMONE, Giuseppina; Monti, SIMONA MARIA; D'Ambrosio, Katia; Langella, Emma
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