Abstract
The model of the lipid bilayer mimicking the inner mitochondrial membrane was constructed. Each layer of the lipid bilayer model consists of 51 dilinoleoyl phosphatidylethanolamine molecules, 36 dilinoleoyl phosphatidylcholine molecules, 35 tetraoleoyl cardiolipin molecules, and 6 dilinoleoyl phosphatidylinositol molecules. This model was analyzed by molecular dynamics simulation (20 000 ps). The mobility of different lipids and groups of atoms involved in the lipids is described. This model can be used to study the lipid component of the inner mitochondrial membrane.
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Funding
The study was financially supported by the Russian Science Foundation (project no. 19-14-00244, molecular dynamics simulations) and the Ministry of Science and Higher Education of the Russian Federation within the framework of the state assignment for the Federal Scientific Research Centre “Crystallography and Photonics” of the Russian Academy of Sciences (analysis of the results of molecular modeling).
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Translated by T. Safonova
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Yurchenko, A.A., Korotkova, P.D., Gusel’nikova, A.R. et al. Modeling of the Lipid Bilayer Mimicking the Inner Mitochondrial Membrane. Crystallogr. Rep. 66, 1006–1009 (2021). https://doi.org/10.1134/S1063774521060432
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DOI: https://doi.org/10.1134/S1063774521060432