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      Effective stiffening of DNA due to nematic ordering causes DNA molecules packed in phage capsids to preferentially form torus knots

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          Abstract

          Observation that DNA molecules in bacteriophage capsids preferentially form torus type of knots provided a sensitive gauge to evaluate various models of DNA arrangement in phage heads. Only models resulting in a preponderance of torus knots could be considered as close to reality. Recent studies revealed that experimentally observed enrichment of torus knots can be qualitatively reproduced in numerical simulations that include a potential inducing nematic arrangement of tightly packed DNA molecules within phage capsids. Here, we investigate what aspects of the nematic arrangement are crucial for inducing formation of torus knots. Our results indicate that the effective stiffening of DNA by the nematic arrangement not only promotes knotting in general but is also the decisive factor in promoting formation of DNA torus knots in phage capsids.

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          Most cited references37

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          Structure of epsilon15 bacteriophage reveals genome organization and DNA packaging/injection apparatus.

          The critical viral components for packaging DNA, recognizing and binding to host cells, and injecting the condensed DNA into the host are organized at a single vertex of many icosahedral viruses. These component structures do not share icosahedral symmetry and cannot be resolved using a conventional icosahedral averaging method. Here we report the structure of the entire infectious Salmonella bacteriophage epsilon15 (ref. 1) determined from single-particle cryo-electron microscopy, without icosahedral averaging. This structure displays not only the icosahedral shell of 60 hexamers and 11 pentamers, but also the non-icosahedral components at one pentameric vertex. The densities at this vertex can be identified as the 12-subunit portal complex sandwiched between an internal cylindrical core and an external tail hub connecting to six projecting trimeric tailspikes. The viral genome is packed as coaxial coils in at least three outer layers with approximately 90 terminal nucleotides extending through the protein core and the portal complex and poised for injection. The shell protein from icosahedral reconstruction at higher resolution exhibits a similar fold to that of other double-stranded DNA viruses including herpesvirus, suggesting a common ancestor among these diverse viruses. The image reconstruction approach should be applicable to studying other biological nanomachines with components of mixed symmetries.
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            Statistical mechanics and topology of polymer chains.

            The statistical-mechanical treatment of closed polymer chains based on algebraic topology is proposed. Using the Monte-Carlo method numerical results were obtained for the probability to knot formation during random closing of polymer chains of different length. For very rigid chains such as DNA double helix the probability of knot formation is rather great. Topological restrictions in a system of two polymer chains are shown to lead to a specific topological interaction between them.
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              Knots in globule and coil phases of a model polyethylene.

              We examine the statistics of knots with numerical simulations of a simplified model of polyethylene. We can simulate polymers of up to 1000 monomers (each representing roughly three CH(2) groups), at a range of temperatures spanning coil (good solvent) and globule (bad solvent) phases. We quantify the abundance of knots in the globule phase and in confined polymers, and their rarity in the swollen phase. Since our polymers are open, we consider (and test) various operational definitions for knots, which are rigorously defined only for closed chains. We also associate a typical size with individual knots, which are found to be small (tight and localized) in the swollen phase but large (loose and spread out) in the dense phases.
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                Author and article information

                Journal
                Nucleic Acids Res
                Nucleic Acids Res
                nar
                nar
                Nucleic Acids Research
                Oxford University Press
                0305-1048
                1362-4962
                June 2012
                June 2012
                22 February 2012
                22 February 2012
                : 40
                : 11
                : 5129-5137
                Affiliations
                1Institut für Physik, Johannes Gutenberg-Universität, 55128 Mainz, Germany, 2Polymer Institute, Slovak Academy of Sciences, 845 41 Bratislava, Slovakia and 3Center for Integrative Genomics, University of Lausanne, 1015 Lausanne, Switzerland
                Author notes
                *To whom correspondence should be addressed. Tel: +41 21 692 4282; Fax: +41 21 692 4115; Email: andrzej.stasiak@ 123456unil.ch
                Article
                gks157
                10.1093/nar/gks157
                3367193
                22362732
                3b4bb6d3-dfb5-4a93-b770-99e10b7e6c4d
                © The Author(s) 2012. Published by Oxford University Press.

                This is an Open Access article distributed under the terms of the Creative Commons Attribution Non-Commercial License ( http://creativecommons.org/licenses/by-nc/3.0), which permits unrestricted non-commercial use, distribution, and reproduction in any medium, provided the original work is properly cited.

                History
                : 9 January 2012
                : 27 January 2012
                : 27 January 2012
                Page count
                Pages: 9
                Categories
                Structural Biology

                Genetics
                Genetics

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