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Mesoscopic model parametrization of hydrogen bonds and stacking interactions of RNA from melting temperatures
Information about molecular interactions in DNA can be obtained from experimental melting temperature data by using mesoscopic statistical physics models. Here, we extend the technique to RNA and show that the new parameters correctly reproduce known properties such as the stronger hydrogen bonds of...
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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Oxford University Press
2013
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3592459/ https://www.ncbi.nlm.nih.gov/pubmed/23087379 http://dx.doi.org/10.1093/nar/gks964 |
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author | Weber, Gerald |
author_facet | Weber, Gerald |
author_sort | Weber, Gerald |
collection | PubMed |
description | Information about molecular interactions in DNA can be obtained from experimental melting temperature data by using mesoscopic statistical physics models. Here, we extend the technique to RNA and show that the new parameters correctly reproduce known properties such as the stronger hydrogen bonds of AU base pairs. We also were able to calculate a complete set of elastic constants for all 10 irreducible combinations of nearest neighbours (NNs). We believe that this is particularly useful as experimentally derived information about RNA elasticity is relatively scarce. The melting temperature prediction using the present model improves over those from traditional NN model, providing thus an alternative way to calculate these temperatures for RNA. Additionally, we calculated the site-dependent base pair oscillation to explain why RNA shows larger oscillation amplitudes despite having stronger AU hydrogen bonds. |
format | Online Article Text |
id | pubmed-3592459 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | Oxford University Press |
record_format | MEDLINE/PubMed |
spelling | pubmed-35924592013-03-08 Mesoscopic model parametrization of hydrogen bonds and stacking interactions of RNA from melting temperatures Weber, Gerald Nucleic Acids Res Methods Online Information about molecular interactions in DNA can be obtained from experimental melting temperature data by using mesoscopic statistical physics models. Here, we extend the technique to RNA and show that the new parameters correctly reproduce known properties such as the stronger hydrogen bonds of AU base pairs. We also were able to calculate a complete set of elastic constants for all 10 irreducible combinations of nearest neighbours (NNs). We believe that this is particularly useful as experimentally derived information about RNA elasticity is relatively scarce. The melting temperature prediction using the present model improves over those from traditional NN model, providing thus an alternative way to calculate these temperatures for RNA. Additionally, we calculated the site-dependent base pair oscillation to explain why RNA shows larger oscillation amplitudes despite having stronger AU hydrogen bonds. Oxford University Press 2013-01 2012-10-18 /pmc/articles/PMC3592459/ /pubmed/23087379 http://dx.doi.org/10.1093/nar/gks964 Text en © The Author(s) 2012. Published by Oxford University Press. http://creativecommons.org/licenses/by-nc/3.0 This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by-nc/3.0/), which permits non-commercial reuse, distribution, and reproduction in any medium, provided the original work is properly cited. For commercial re-use, please contact journals.permissions@oup.com. |
spellingShingle | Methods Online Weber, Gerald Mesoscopic model parametrization of hydrogen bonds and stacking interactions of RNA from melting temperatures |
title | Mesoscopic model parametrization of hydrogen bonds and stacking interactions of RNA from melting temperatures |
title_full | Mesoscopic model parametrization of hydrogen bonds and stacking interactions of RNA from melting temperatures |
title_fullStr | Mesoscopic model parametrization of hydrogen bonds and stacking interactions of RNA from melting temperatures |
title_full_unstemmed | Mesoscopic model parametrization of hydrogen bonds and stacking interactions of RNA from melting temperatures |
title_short | Mesoscopic model parametrization of hydrogen bonds and stacking interactions of RNA from melting temperatures |
title_sort | mesoscopic model parametrization of hydrogen bonds and stacking interactions of rna from melting temperatures |
topic | Methods Online |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3592459/ https://www.ncbi.nlm.nih.gov/pubmed/23087379 http://dx.doi.org/10.1093/nar/gks964 |
work_keys_str_mv | AT webergerald mesoscopicmodelparametrizationofhydrogenbondsandstackinginteractionsofrnafrommeltingtemperatures |