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Prediction of binding hot spot residues by using structural and evolutionary parameters

In this work, we present a method for predicting hot spot residues by using a set of structural and evolutionary parameters. Unlike previous studies, we use a set of parameters which do not depend on the structure of the protein in complex, so that the predictor can also be used when the interface r...

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Detalles Bibliográficos
Autores principales: Higa, Roberto Hiroshi, Tozzi, Clésio Luis
Formato: Texto
Lenguaje:English
Publicado: Sociedade Brasileira de Genética 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3036045/
https://www.ncbi.nlm.nih.gov/pubmed/21637529
http://dx.doi.org/10.1590/S1415-47572009000300029
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author Higa, Roberto Hiroshi
Tozzi, Clésio Luis
author_facet Higa, Roberto Hiroshi
Tozzi, Clésio Luis
author_sort Higa, Roberto Hiroshi
collection PubMed
description In this work, we present a method for predicting hot spot residues by using a set of structural and evolutionary parameters. Unlike previous studies, we use a set of parameters which do not depend on the structure of the protein in complex, so that the predictor can also be used when the interface region is unknown. Despite the fact that no information concerning proteins in complex is used for prediction, the application of the method to a compiled dataset described in the literature achieved a performance of 60.4%, as measured by F-Measure, corresponding to a recall of 78.1% and a precision of 49.5%. This result is higher than those reported by previous studies using the same data set.
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spelling pubmed-30360452011-06-02 Prediction of binding hot spot residues by using structural and evolutionary parameters Higa, Roberto Hiroshi Tozzi, Clésio Luis Genet Mol Biol Genomics and Bioinformatics In this work, we present a method for predicting hot spot residues by using a set of structural and evolutionary parameters. Unlike previous studies, we use a set of parameters which do not depend on the structure of the protein in complex, so that the predictor can also be used when the interface region is unknown. Despite the fact that no information concerning proteins in complex is used for prediction, the application of the method to a compiled dataset described in the literature achieved a performance of 60.4%, as measured by F-Measure, corresponding to a recall of 78.1% and a precision of 49.5%. This result is higher than those reported by previous studies using the same data set. Sociedade Brasileira de Genética 2009 2009-09-01 /pmc/articles/PMC3036045/ /pubmed/21637529 http://dx.doi.org/10.1590/S1415-47572009000300029 Text en Copyright © 2009, Sociedade Brasileira de Genética. http://creativecommons.org/licenses/by/2.0/ This is an open-access article distributed under the terms of the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.
spellingShingle Genomics and Bioinformatics
Higa, Roberto Hiroshi
Tozzi, Clésio Luis
Prediction of binding hot spot residues by using structural and evolutionary parameters
title Prediction of binding hot spot residues by using structural and evolutionary parameters
title_full Prediction of binding hot spot residues by using structural and evolutionary parameters
title_fullStr Prediction of binding hot spot residues by using structural and evolutionary parameters
title_full_unstemmed Prediction of binding hot spot residues by using structural and evolutionary parameters
title_short Prediction of binding hot spot residues by using structural and evolutionary parameters
title_sort prediction of binding hot spot residues by using structural and evolutionary parameters
topic Genomics and Bioinformatics
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3036045/
https://www.ncbi.nlm.nih.gov/pubmed/21637529
http://dx.doi.org/10.1590/S1415-47572009000300029
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