English

Dynamic transition from $\alpha$-helices to $\beta$-sheets in polypeptide superhelices

Biological Physics 2017-03-10 v2 Materials Science Soft Condensed Matter Chemical Physics

Abstract

We carried out dynamic force manipulations inin silicosilico on a variety of superhelical protein fragments from myosin, chemotaxis receptor, vimentin, fibrin, and phenylalanine zippers that vary in size and topology of their α\alpha-helical packing. When stretched along the superhelical axis, all superhelices show elastic, plastic, and inelastic elongation regimes, and undergo a dynamic transition from the α\alpha-helices to the β\beta-sheets, which marks the onset of plastic deformation. Using Abeyaratne-Knowles formulation of phase transitions, we developed a theory to model mechanical and kinetic properties of protein superhelices under mechanical non-equilibrium conditions and to map their energy landscapes. The theory was validated by comparing the simulated and theoretical force-strain spectra. Scaling laws for the elastic force and the force for α\alpha-to-β\beta transition to plastic deformation can be used to rationally design new materials of required mechanical strength with desired balance between stiffness and plasticity.

Keywords

Cite

@article{arxiv.1703.02922,
  title  = {Dynamic transition from $\alpha$-helices to $\beta$-sheets in polypeptide superhelices},
  author = {Kirill A. Minin and Artem Zhmurov and Kenneth A. Marx and Prashant K. Purohit and Valeri Barsegov},
  journal= {arXiv preprint arXiv:1703.02922},
  year   = {2017}
}
R2 v1 2026-06-22T18:39:56.202Z