Insights into the binding mode of sulphamates and sulphamides to hCA II: crystallographic studies and binding free energy calculations

Sulphamate and sulphamide derivatives have been largely investigated as carbonic anhydrase inhibitors (CAIs) by means of different experimental techniques. However, the structural determinants responsible for their different binding mode to the enzyme active site were not clearly defined so far. In...

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Detalles Bibliográficos
Autores principales: De Simone, Giuseppina, Langella, Emma, Esposito, Davide, Supuran, Claudiu T., Monti, Simona Maria, Winum, Jean-Yves, Alterio, Vincenzo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Taylor & Francis 2017
Materias:
Research Paper
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6445192/
https://www.ncbi.nlm.nih.gov/pubmed/28738704
http://dx.doi.org/10.1080/14756366.2017.1349764

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6445192/
https://www.ncbi.nlm.nih.gov/pubmed/28738704
http://dx.doi.org/10.1080/14756366.2017.1349764

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