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Current developments in Coot for macromolecular model building of Electron Cryo‐microscopy and Crystallographic Data
Coot is a tool widely used for model building, refinement, and validation of macromolecular structures. It has been extensively used for crystallography and, more recently, improvements have been introduced to aid in cryo‐EM model building and refinement, as cryo‐EM structures with resolution rangin...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
John Wiley & Sons, Inc.
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7096722/ https://www.ncbi.nlm.nih.gov/pubmed/31730249 http://dx.doi.org/10.1002/pro.3791 |
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author | Casañal, Ana Lohkamp, Bernhard Emsley, Paul |
author_facet | Casañal, Ana Lohkamp, Bernhard Emsley, Paul |
author_sort | Casañal, Ana |
collection | PubMed |
description | Coot is a tool widely used for model building, refinement, and validation of macromolecular structures. It has been extensively used for crystallography and, more recently, improvements have been introduced to aid in cryo‐EM model building and refinement, as cryo‐EM structures with resolution ranging 2.5–4 A are now routinely available. Model building into these maps can be time‐consuming and requires experience in both biochemistry and building into low‐resolution maps. To simplify and expedite the model building task, and minimize the needed expertise, new tools are being added in Coot. Some examples include morphing, Geman‐McClure restraints, full‐chain refinement, and Fourier‐model based residue‐type‐specific Ramachandran restraints. Here, we present the current state‐of‐the‐art in Coot usage. |
format | Online Article Text |
id | pubmed-7096722 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2020 |
publisher | John Wiley & Sons, Inc. |
record_format | MEDLINE/PubMed |
spelling | pubmed-70967222020-03-26 Current developments in Coot for macromolecular model building of Electron Cryo‐microscopy and Crystallographic Data Casañal, Ana Lohkamp, Bernhard Emsley, Paul Protein Sci Tools for Protein Science Coot is a tool widely used for model building, refinement, and validation of macromolecular structures. It has been extensively used for crystallography and, more recently, improvements have been introduced to aid in cryo‐EM model building and refinement, as cryo‐EM structures with resolution ranging 2.5–4 A are now routinely available. Model building into these maps can be time‐consuming and requires experience in both biochemistry and building into low‐resolution maps. To simplify and expedite the model building task, and minimize the needed expertise, new tools are being added in Coot. Some examples include morphing, Geman‐McClure restraints, full‐chain refinement, and Fourier‐model based residue‐type‐specific Ramachandran restraints. Here, we present the current state‐of‐the‐art in Coot usage. John Wiley & Sons, Inc. 2020-03-02 2020-04 /pmc/articles/PMC7096722/ /pubmed/31730249 http://dx.doi.org/10.1002/pro.3791 Text en © 2019 The Authors. Protein Science published by Wiley Periodicals, Inc. on behalf of The Protein Society. This is an open access article under the terms of the http://creativecommons.org/licenses/by/4.0/ License, which permits use, distribution and reproduction in any medium, provided the original work is properly cited. |
spellingShingle | Tools for Protein Science Casañal, Ana Lohkamp, Bernhard Emsley, Paul Current developments in Coot for macromolecular model building of Electron Cryo‐microscopy and Crystallographic Data |
title | Current developments in Coot for macromolecular model building of Electron Cryo‐microscopy and Crystallographic Data |
title_full | Current developments in Coot for macromolecular model building of Electron Cryo‐microscopy and Crystallographic Data |
title_fullStr | Current developments in Coot for macromolecular model building of Electron Cryo‐microscopy and Crystallographic Data |
title_full_unstemmed | Current developments in Coot for macromolecular model building of Electron Cryo‐microscopy and Crystallographic Data |
title_short | Current developments in Coot for macromolecular model building of Electron Cryo‐microscopy and Crystallographic Data |
title_sort | current developments in coot for macromolecular model building of electron cryo‐microscopy and crystallographic data |
topic | Tools for Protein Science |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7096722/ https://www.ncbi.nlm.nih.gov/pubmed/31730249 http://dx.doi.org/10.1002/pro.3791 |
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