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IntFOLD: an integrated web resource for high performance protein structure and function prediction

The IntFOLD server provides a unified resource for the automated prediction of: protein tertiary structures with built-in estimates of model accuracy (EMA), protein structural domain boundaries, natively unstructured or disordered regions in proteins, and protein–ligand interactions. The component m...

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Autores principales: McGuffin, Liam J, Adiyaman, Recep, Maghrabi, Ali H A, Shuid, Ahmad N, Brackenridge, Danielle A, Nealon, John O, Philomina, Limcy S
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6602432/
https://www.ncbi.nlm.nih.gov/pubmed/31045208
http://dx.doi.org/10.1093/nar/gkz322
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author McGuffin, Liam J
Adiyaman, Recep
Maghrabi, Ali H A
Shuid, Ahmad N
Brackenridge, Danielle A
Nealon, John O
Philomina, Limcy S
author_facet McGuffin, Liam J
Adiyaman, Recep
Maghrabi, Ali H A
Shuid, Ahmad N
Brackenridge, Danielle A
Nealon, John O
Philomina, Limcy S
author_sort McGuffin, Liam J
collection PubMed
description The IntFOLD server provides a unified resource for the automated prediction of: protein tertiary structures with built-in estimates of model accuracy (EMA), protein structural domain boundaries, natively unstructured or disordered regions in proteins, and protein–ligand interactions. The component methods have been independently evaluated via the successive blind CASP experiments and the continual CAMEO benchmarking project. The IntFOLD server has established its ranking as one of the best performing publicly available servers, based on independent official evaluation metrics. Here, we describe significant updates to the server back end, where we have focused on performance improvements in tertiary structure predictions, in terms of global 3D model quality and accuracy self-estimates (ASE), which we achieve using our newly improved ModFOLD7_rank algorithm. We also report on various upgrades to the front end including: a streamlined submission process, enhanced visualization of models, new confidence scores for ranking, and links for accessing all annotated model data. Furthermore, we now include an option for users to submit selected models for further refinement via convenient push buttons. The IntFOLD server is freely available at: http://www.reading.ac.uk/bioinf/IntFOLD/.
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spelling pubmed-66024322019-07-05 IntFOLD: an integrated web resource for high performance protein structure and function prediction McGuffin, Liam J Adiyaman, Recep Maghrabi, Ali H A Shuid, Ahmad N Brackenridge, Danielle A Nealon, John O Philomina, Limcy S Nucleic Acids Res Web Server Issue The IntFOLD server provides a unified resource for the automated prediction of: protein tertiary structures with built-in estimates of model accuracy (EMA), protein structural domain boundaries, natively unstructured or disordered regions in proteins, and protein–ligand interactions. The component methods have been independently evaluated via the successive blind CASP experiments and the continual CAMEO benchmarking project. The IntFOLD server has established its ranking as one of the best performing publicly available servers, based on independent official evaluation metrics. Here, we describe significant updates to the server back end, where we have focused on performance improvements in tertiary structure predictions, in terms of global 3D model quality and accuracy self-estimates (ASE), which we achieve using our newly improved ModFOLD7_rank algorithm. We also report on various upgrades to the front end including: a streamlined submission process, enhanced visualization of models, new confidence scores for ranking, and links for accessing all annotated model data. Furthermore, we now include an option for users to submit selected models for further refinement via convenient push buttons. The IntFOLD server is freely available at: http://www.reading.ac.uk/bioinf/IntFOLD/. Oxford University Press 2019-07-02 2019-05-02 /pmc/articles/PMC6602432/ /pubmed/31045208 http://dx.doi.org/10.1093/nar/gkz322 Text en © The Author(s) 2019. Published by Oxford University Press on behalf of Nucleic Acids Research. http://creativecommons.org/licenses/by/4.0/ This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricted reuse, distribution, and reproduction in any medium, provided the original work is properly cited.
spellingShingle Web Server Issue
McGuffin, Liam J
Adiyaman, Recep
Maghrabi, Ali H A
Shuid, Ahmad N
Brackenridge, Danielle A
Nealon, John O
Philomina, Limcy S
IntFOLD: an integrated web resource for high performance protein structure and function prediction
title IntFOLD: an integrated web resource for high performance protein structure and function prediction
title_full IntFOLD: an integrated web resource for high performance protein structure and function prediction
title_fullStr IntFOLD: an integrated web resource for high performance protein structure and function prediction
title_full_unstemmed IntFOLD: an integrated web resource for high performance protein structure and function prediction
title_short IntFOLD: an integrated web resource for high performance protein structure and function prediction
title_sort intfold: an integrated web resource for high performance protein structure and function prediction
topic Web Server Issue
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6602432/
https://www.ncbi.nlm.nih.gov/pubmed/31045208
http://dx.doi.org/10.1093/nar/gkz322
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