Electrostatic Switch Function in the Mechanism of Protein Kinase A Iα Activation: Results of the Molecular Dynamics Simulation

We used molecular dynamics to find the average path of the A-domain H→B conformational transition in protein kinase A Iα. We obtained thirteen productive trajectories and processed them sequentially using factor and cross-correlation analyses. The conformational transition is presented as partly det...

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Bibliographic Details
Main Authors: Olga N. Rogacheva, Boris F. Shchegolev, Elena A. Vershinina, Alexander A. Tokmakov, Vasiliy E. Stefanov
Format: Article
Language:English
Published: Hindawi Limited 2017-01-01
Series:BioMed Research International
Online Access:http://dx.doi.org/10.1155/2017/5846073