WEBnm@: a web application for normal mode analyses of proteins

<p>Abstract</p> <p>Background</p> <p>Normal mode analysis (NMA) has become the method of choice to investigate the slowest motions in macromolecular systems. NMA is especially useful for large biomolecular assemblies, such as transmembrane channels or virus capsids. NMA...

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Main Authors: Reuter Nathalie, Salensminde Gisle, Hollup Siv
Format: Article
Language:English
Published: BMC 2005-03-01
Series:BMC Bioinformatics
Online Access:http://www.biomedcentral.com/1471-2105/6/52
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spelling doaj-0b9a7a5cbbd544bcae74bec6ff8980272020-11-25T00:37:40ZengBMCBMC Bioinformatics1471-21052005-03-01615210.1186/1471-2105-6-52WEBnm@: a web application for normal mode analyses of proteinsReuter NathalieSalensminde GisleHollup Siv<p>Abstract</p> <p>Background</p> <p>Normal mode analysis (NMA) has become the method of choice to investigate the slowest motions in macromolecular systems. NMA is especially useful for large biomolecular assemblies, such as transmembrane channels or virus capsids. NMA relies on the hypothesis that the vibrational normal modes having the lowest frequencies (also named soft modes) describe the largest movements in a protein and are the ones that are functionally relevant.</p> <p>Results</p> <p>We developed a web-based server to perform normal modes calculations and different types of analyses. Starting from a structure file provided by the user in the PDB format, the server calculates the normal modes and subsequently offers the user a series of automated calculations; normalized squared atomic displacements, vector field representation and animation of the first six vibrational modes. Each analysis is performed independently from the others and results can be visualized using only a web browser. No additional plug-in or software is required. For users who would like to analyze the results with their favorite software, raw results can also be downloaded. The application is available on <url>http://www.bioinfo.no/tools/normalmodes</url>. We present here the underlying theory, the application architecture and an illustration of its features using a large transmembrane protein as an example.</p> <p>Conclusion</p> <p>We built an efficient and modular web application for normal mode analysis of proteins. Non specialists can easily and rapidly evaluate the degree of flexibility of multi-domain protein assemblies and characterize the large amplitude movements of their domains.</p> http://www.biomedcentral.com/1471-2105/6/52
collection DOAJ
language English
format Article
sources DOAJ
author Reuter Nathalie
Salensminde Gisle
Hollup Siv
spellingShingle Reuter Nathalie
Salensminde Gisle
Hollup Siv
WEBnm@: a web application for normal mode analyses of proteins
BMC Bioinformatics
author_facet Reuter Nathalie
Salensminde Gisle
Hollup Siv
author_sort Reuter Nathalie
title WEBnm@: a web application for normal mode analyses of proteins
title_short WEBnm@: a web application for normal mode analyses of proteins
title_full WEBnm@: a web application for normal mode analyses of proteins
title_fullStr WEBnm@: a web application for normal mode analyses of proteins
title_full_unstemmed WEBnm@: a web application for normal mode analyses of proteins
title_sort webnm@: a web application for normal mode analyses of proteins
publisher BMC
series BMC Bioinformatics
issn 1471-2105
publishDate 2005-03-01
description <p>Abstract</p> <p>Background</p> <p>Normal mode analysis (NMA) has become the method of choice to investigate the slowest motions in macromolecular systems. NMA is especially useful for large biomolecular assemblies, such as transmembrane channels or virus capsids. NMA relies on the hypothesis that the vibrational normal modes having the lowest frequencies (also named soft modes) describe the largest movements in a protein and are the ones that are functionally relevant.</p> <p>Results</p> <p>We developed a web-based server to perform normal modes calculations and different types of analyses. Starting from a structure file provided by the user in the PDB format, the server calculates the normal modes and subsequently offers the user a series of automated calculations; normalized squared atomic displacements, vector field representation and animation of the first six vibrational modes. Each analysis is performed independently from the others and results can be visualized using only a web browser. No additional plug-in or software is required. For users who would like to analyze the results with their favorite software, raw results can also be downloaded. The application is available on <url>http://www.bioinfo.no/tools/normalmodes</url>. We present here the underlying theory, the application architecture and an illustration of its features using a large transmembrane protein as an example.</p> <p>Conclusion</p> <p>We built an efficient and modular web application for normal mode analysis of proteins. Non specialists can easily and rapidly evaluate the degree of flexibility of multi-domain protein assemblies and characterize the large amplitude movements of their domains.</p>
url http://www.biomedcentral.com/1471-2105/6/52
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