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GOMoDo: A GPCRs Online Modeling and Docking Webserver

G-protein coupled receptors (GPCRs) are a superfamily of cell signaling membrane proteins that include >750 members in the human genome alone. They are the largest family of drug targets. The vast diversity and relevance of GPCRs contrasts with the paucity of structures available: only 21 unique...

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Autores principales: Sandal, Massimo, Duy, Tran Phuoc, Cona, Matteo, Zung, Hoang, Carloni, Paolo, Musiani, Francesco, Giorgetti, Alejandro
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3772745/
https://www.ncbi.nlm.nih.gov/pubmed/24058518
http://dx.doi.org/10.1371/journal.pone.0074092
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author Sandal, Massimo
Duy, Tran Phuoc
Cona, Matteo
Zung, Hoang
Carloni, Paolo
Musiani, Francesco
Giorgetti, Alejandro
author_facet Sandal, Massimo
Duy, Tran Phuoc
Cona, Matteo
Zung, Hoang
Carloni, Paolo
Musiani, Francesco
Giorgetti, Alejandro
author_sort Sandal, Massimo
collection PubMed
description G-protein coupled receptors (GPCRs) are a superfamily of cell signaling membrane proteins that include >750 members in the human genome alone. They are the largest family of drug targets. The vast diversity and relevance of GPCRs contrasts with the paucity of structures available: only 21 unique GPCR structures have been experimentally determined as of the beginning of 2013. User-friendly modeling and small molecule docking tools are thus in great demand. While both GPCR structural predictions and docking servers exist separately, with GOMoDo (GPCR Online M odeling and D ocking), we provide a web server to seamlessly model GPCR structures and dock ligands to the models in a single consistent pipeline. GOMoDo can automatically perform template choice, homology modeling and either blind or information-driven docking by combining together proven, state of the art bioinformatic tools. The web server gives the user the possibility of guiding the whole procedure. The GOMoDo server is freely accessible at http://molsim.sci.univr.it/gomodo.
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spelling pubmed-37727452013-09-20 GOMoDo: A GPCRs Online Modeling and Docking Webserver Sandal, Massimo Duy, Tran Phuoc Cona, Matteo Zung, Hoang Carloni, Paolo Musiani, Francesco Giorgetti, Alejandro PLoS One Research Article G-protein coupled receptors (GPCRs) are a superfamily of cell signaling membrane proteins that include >750 members in the human genome alone. They are the largest family of drug targets. The vast diversity and relevance of GPCRs contrasts with the paucity of structures available: only 21 unique GPCR structures have been experimentally determined as of the beginning of 2013. User-friendly modeling and small molecule docking tools are thus in great demand. While both GPCR structural predictions and docking servers exist separately, with GOMoDo (GPCR Online M odeling and D ocking), we provide a web server to seamlessly model GPCR structures and dock ligands to the models in a single consistent pipeline. GOMoDo can automatically perform template choice, homology modeling and either blind or information-driven docking by combining together proven, state of the art bioinformatic tools. The web server gives the user the possibility of guiding the whole procedure. The GOMoDo server is freely accessible at http://molsim.sci.univr.it/gomodo. Public Library of Science 2013-09-06 /pmc/articles/PMC3772745/ /pubmed/24058518 http://dx.doi.org/10.1371/journal.pone.0074092 Text en © 2013 Sandal et al http://creativecommons.org/licenses/by/4.0/ 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 author and source are properly credited.
spellingShingle Research Article
Sandal, Massimo
Duy, Tran Phuoc
Cona, Matteo
Zung, Hoang
Carloni, Paolo
Musiani, Francesco
Giorgetti, Alejandro
GOMoDo: A GPCRs Online Modeling and Docking Webserver
title GOMoDo: A GPCRs Online Modeling and Docking Webserver
title_full GOMoDo: A GPCRs Online Modeling and Docking Webserver
title_fullStr GOMoDo: A GPCRs Online Modeling and Docking Webserver
title_full_unstemmed GOMoDo: A GPCRs Online Modeling and Docking Webserver
title_short GOMoDo: A GPCRs Online Modeling and Docking Webserver
title_sort gomodo: a gpcrs online modeling and docking webserver
topic Research Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3772745/
https://www.ncbi.nlm.nih.gov/pubmed/24058518
http://dx.doi.org/10.1371/journal.pone.0074092
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