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COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures

Hydrogen bonds are crucial factors that stabilize a complex ribonucleic acid (RNA) molecule's three-dimensional (3D) structure. Minute conformational changes can result in variations in the hydrogen bond interactions in a particular structure. Furthermore, networks of hydrogen bonds, especially...

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Autores principales: Firdaus-Raih, Mohd, Hamdani, Hazrina Yusof, Nadzirin, Nurul, Ramlan, Effirul Ikhwan, Willett, Peter, Artymiuk, Peter J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4086061/
https://www.ncbi.nlm.nih.gov/pubmed/24831543
http://dx.doi.org/10.1093/nar/gku438
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author Firdaus-Raih, Mohd
Hamdani, Hazrina Yusof
Nadzirin, Nurul
Ramlan, Effirul Ikhwan
Willett, Peter
Artymiuk, Peter J.
author_facet Firdaus-Raih, Mohd
Hamdani, Hazrina Yusof
Nadzirin, Nurul
Ramlan, Effirul Ikhwan
Willett, Peter
Artymiuk, Peter J.
author_sort Firdaus-Raih, Mohd
collection PubMed
description Hydrogen bonds are crucial factors that stabilize a complex ribonucleic acid (RNA) molecule's three-dimensional (3D) structure. Minute conformational changes can result in variations in the hydrogen bond interactions in a particular structure. Furthermore, networks of hydrogen bonds, especially those found in tight clusters, may be important elements in structure stabilization or function and can therefore be regarded as potential tertiary motifs. In this paper, we describe a graph theoretical algorithm implemented as a web server that is able to search for unbroken networks of hydrogen-bonded base interactions and thus provide an accounting of such interactions in RNA 3D structures. This server, COGNAC (COnnection tables Graphs for Nucleic ACids), is also able to compare the hydrogen bond networks between two structures and from such annotations enable the mapping of atomic level differences that may have resulted from conformational changes due to mutations or binding events. The COGNAC server can be accessed at http://mfrlab.org/grafss/cognac.
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spelling pubmed-40860612014-10-28 COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures Firdaus-Raih, Mohd Hamdani, Hazrina Yusof Nadzirin, Nurul Ramlan, Effirul Ikhwan Willett, Peter Artymiuk, Peter J. Nucleic Acids Res Article Hydrogen bonds are crucial factors that stabilize a complex ribonucleic acid (RNA) molecule's three-dimensional (3D) structure. Minute conformational changes can result in variations in the hydrogen bond interactions in a particular structure. Furthermore, networks of hydrogen bonds, especially those found in tight clusters, may be important elements in structure stabilization or function and can therefore be regarded as potential tertiary motifs. In this paper, we describe a graph theoretical algorithm implemented as a web server that is able to search for unbroken networks of hydrogen-bonded base interactions and thus provide an accounting of such interactions in RNA 3D structures. This server, COGNAC (COnnection tables Graphs for Nucleic ACids), is also able to compare the hydrogen bond networks between two structures and from such annotations enable the mapping of atomic level differences that may have resulted from conformational changes due to mutations or binding events. The COGNAC server can be accessed at http://mfrlab.org/grafss/cognac. Oxford University Press 2014-07-01 2014-05-15 /pmc/articles/PMC4086061/ /pubmed/24831543 http://dx.doi.org/10.1093/nar/gku438 Text en © The Author(s) 2014. Published by Oxford University Press on behalf of Nucleic Acids Research. http://creativecommons.org/licenses/by/3.0/ This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/3.0/), which permits unrestricted reuse, distribution, and reproduction in any medium, provided the original work is properly cited.
spellingShingle Article
Firdaus-Raih, Mohd
Hamdani, Hazrina Yusof
Nadzirin, Nurul
Ramlan, Effirul Ikhwan
Willett, Peter
Artymiuk, Peter J.
COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures
title COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures
title_full COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures
title_fullStr COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures
title_full_unstemmed COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures
title_short COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures
title_sort cognac: a web server for searching and annotating hydrogen-bonded base interactions in rna three-dimensional structures
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4086061/
https://www.ncbi.nlm.nih.gov/pubmed/24831543
http://dx.doi.org/10.1093/nar/gku438
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