Free Energy of Cell-Penetrating Peptide through Lipid Bilayer Membrane: Coarse-Grained Model Simulation View Full Text


Ontology type: schema:Chapter     


Chapter Info

DATE

2012-10-29

AUTHORS

S. Kawamoto , M. Takasu , T. Miyakawa , R. Morikawa , T. Oda , H. Saito , S. Futaki , H. Nagao , W. Shinoda

ABSTRACT

Cell-penetrating peptides can permeate through the plasma membrane. The permeation ability is useful for delivery of bioactive molecules. Experiments suggest that the binding between the guanidino group in the peptide and lipid headgroups is of crucial importance in the peptide permeation through lipid membranes. We investigate the free energy profile for the permeation of the peptide through the lipid bilayer membrane with changing the binding strength by a series of coarse-grained molecular dynamics simulation. We found that the energy barrier for the permeation has the minimum at the medium strength of the binding (∼2ε). Our result suggests that the appropriate attractive interaction between peptide and lipid headgroups enhances the permeation of the peptide across the lipid membranes. More... »

PAGES

503-511

Identifiers

URI

http://scigraph.springernature.com/pub.10.1007/978-94-007-5297-9_29

DOI

http://dx.doi.org/10.1007/978-94-007-5297-9_29

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1013576108


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188 schema:name School of Life Sciences, Tokyo University of Pharmacy and Life Sciences, Horinouch, 192-0392, Hachioji, Tokyo, Japan
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190 grid-institutes:grid.9707.9 schema:alternateName Graduate School of Natural Science and Technology, Kanazawa University, 920-1192, Kakuma, Kanazawas, Ishikawa, Japan
191 schema:name Graduate School of Natural Science and Technology, Kanazawa University, 920-1192, Kakuma, Kanazawas, Ishikawa, Japan
192 rdf:type schema:Organization
 




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