Intriguing role of water in protein-ligand binding studied by neutron crystallography on trypsin complexes

Hydrogen bonds are key interactions determining protein-ligand binding affinity and therefore fundamental to any biological process. Unfortunately, explicit structural information about hydrogen positions and thus H-bonds in protein-ligand complexes is extremely rare and similarly the important role...

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Detalles Bibliográficos
Autores principales: Schiebel, Johannes, Gaspari, Roberto, Wulsdorf, Tobias, Ngo, Khang, Sohn, Christian, Schrader, Tobias E., Cavalli, Andrea, Ostermann, Andreas, Heine, Andreas, Klebe, Gerhard
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2018
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6120877/
https://www.ncbi.nlm.nih.gov/pubmed/30177695
http://dx.doi.org/10.1038/s41467-018-05769-2

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