Configurational transitions in Fourier series-represented DNA supercoils.

Abstract:

:A new Fourier series representation of supercoiled DNA is employed in Langevin dynamics simulations to study large-scale configurational motions of intermediate-length chains. The polymer is modeled as an ideal elastic rod subject to long-range van der Waals' interactions. The van der Waals' term prevents the self-contact of distant chain segments and also mimics attractive forces thought to stabilize the association of closely spaced charged rods. The finite Fourier series-derived polymer formulation is an alternative to the piecewise B-spline curves used in past work to describe the motion of smoothly deformed supercoiled DNA in terms of a limited number of independent variables. This study focuses on two large-scale configurational events: the interconversion between circular and figure-8 forms at a relatively low level of supercoiling, and the transformation between branched and interwound structures at a higher superhelical density.

journal_name

Biophys J

journal_title

Biophysical journal

authors

Liu G,Schlick T,Olson AJ,Olson WK

doi

10.1016/S0006-3495(97)78205-5

subject

Has Abstract

pub_date

1997-10-01 00:00:00

pages

1742-62

issue

4

eissn

0006-3495

issn

1542-0086

pii

S0006-3495(97)78205-5

journal_volume

73

pub_type

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