Characterization of the KRas G12D-inhibitor interactions by differential HDX-MS and molecular dynamics simulations

Hydrogen-deuterium exchange (HDX) combined with mass spectrometry (MS) is a powerful technique for studying changes in protein structure and dynamics upon ligand binding. Protein-ligand complexes can result in increased protection of peptide-bond amides in HDX indicating protein structure stabilizat...

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Autors principals:	Evgeniy V. Petrotchenko, Brandon Novy, Edith Nagy, Konstantin I. Popov, Jason B. Cross, Roopa Thapar, Christoph H. Borchers
Format:	Artigo
Idioma:	Inglês
Publicat:	American Association for the Advancement of Science (AAAS) 2025-01-01
Col·lecció:	Computational and Structural Biotechnology Journal
Matèries:	hydrogen-deuterium exchange mass spectrometry molecular dynamics proteindrug binding
Accés en línia:	http://www.sciencedirect.com/science/article/pii/S2001037025003307
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