Practical Considerations for Atomistic Structure Modeling with Cryo-EM Maps.


Journal

Journal of chemical information and modeling
ISSN: 1549-960X
Titre abrégé: J Chem Inf Model
Pays: United States
ID NLM: 101230060

Informations de publication

Date de publication:
26 05 2020
Historique:
pubmed: 19 5 2020
medline: 22 6 2021
entrez: 19 5 2020
Statut: ppublish

Résumé

We describe common approaches to atomistic structure modeling with single particle analysis derived cryo-EM maps. Several strategies for atomistic model building and atomistic model fitting methods are discussed, including selection criteria and implementation procedures. In covering basic concepts and caveats, this short perspective aims to help facilitate active discussion between scientists at different levels with diverse backgrounds.

Identifiants

pubmed: 32422044
doi: 10.1021/acs.jcim.0c00090
pmc: PMC7891309
mid: NIHMS1661714
doi:

Substances chimiques

Proteins 0

Types de publication

Journal Article Research Support, N.I.H., Extramural Research Support, Non-U.S. Gov't Research Support, U.S. Gov't, Non-P.H.S.

Langues

eng

Sous-ensembles de citation

IM

Pagination

2436-2442

Subventions

Organisme : NIGMS NIH HHS
ID : R01 GM072686
Pays : United States

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Auteurs

Doo Nam Kim (DN)

Computational Biology Team, Biological Science Division, Pacific Northwest National Laboratory, Richland, Washington 99354, United States.

Dominik Gront (D)

Faculty of Chemistry, Biological and Chemical Research Center, University of Warsaw, Pasteura 1, 02-093 Warsaw, Poland.

Karissa Y Sanbonmatsu (KY)

Theoretical Biology and Biophysics Group, Los Alamos National Laboratory, Los Alamos, New Mexico 87545, United States.
New Mexico Consortium, Los Alamos, New Mexico 87544, United States.

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Classifications MeSH