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Advances in X-ray free electron laser (XFEL) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / SNARE complex

X-ray free electron lasers (XFELs) reduce the effects of radiation damage on macromolecular diffraction data and thereby extend the limiting resolution. Previously, we adapted classical post-refinement techniques to XFEL diffraction data to produce accurate diffraction data sets from a limited numbe...

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Autores principales: Lyubimov, Artem Y, Uervirojnangkoorn, Monarin, Zeldin, Oliver B, Zhou, Qiangjun, Zhao, Minglei, Brewster, Aaron S, Michels-Clark, Tara, Holton, James M, Sauter, Nicholas K, Weis, William I, Brunger, Axel T
Formato: Online Artículo Texto
Lenguaje:English
Publicado: eLife Sciences Publications, Ltd 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5094853/
https://www.ncbi.nlm.nih.gov/pubmed/27731796
http://dx.doi.org/10.7554/eLife.18740
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author Lyubimov, Artem Y
Uervirojnangkoorn, Monarin
Zeldin, Oliver B
Zhou, Qiangjun
Zhao, Minglei
Brewster, Aaron S
Michels-Clark, Tara
Holton, James M
Sauter, Nicholas K
Weis, William I
Brunger, Axel T
author_facet Lyubimov, Artem Y
Uervirojnangkoorn, Monarin
Zeldin, Oliver B
Zhou, Qiangjun
Zhao, Minglei
Brewster, Aaron S
Michels-Clark, Tara
Holton, James M
Sauter, Nicholas K
Weis, William I
Brunger, Axel T
author_sort Lyubimov, Artem Y
collection PubMed
description X-ray free electron lasers (XFELs) reduce the effects of radiation damage on macromolecular diffraction data and thereby extend the limiting resolution. Previously, we adapted classical post-refinement techniques to XFEL diffraction data to produce accurate diffraction data sets from a limited number of diffraction images (Uervirojnangkoorn et al., 2015), and went on to use these techniques to obtain a complete data set from crystals of the synaptotagmin-1 / SNARE complex and to determine the structure at 3.5 Å resolution (Zhou et al., 2015). Here, we describe new advances in our methods and present a reprocessed XFEL data set of the synaptotagmin-1 / SNARE complex. The reprocessing produced small improvements in electron density maps and the refined atomic model. The maps also contained more information than those of a lower resolution (4.1 Å) synchrotron data set. Processing a set of simulated XFEL diffraction images revealed that our methods yield accurate data and atomic models. DOI: http://dx.doi.org/10.7554/eLife.18740.001
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spelling pubmed-50948532016-11-04 Advances in X-ray free electron laser (XFEL) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / SNARE complex Lyubimov, Artem Y Uervirojnangkoorn, Monarin Zeldin, Oliver B Zhou, Qiangjun Zhao, Minglei Brewster, Aaron S Michels-Clark, Tara Holton, James M Sauter, Nicholas K Weis, William I Brunger, Axel T eLife Biophysics and Structural Biology X-ray free electron lasers (XFELs) reduce the effects of radiation damage on macromolecular diffraction data and thereby extend the limiting resolution. Previously, we adapted classical post-refinement techniques to XFEL diffraction data to produce accurate diffraction data sets from a limited number of diffraction images (Uervirojnangkoorn et al., 2015), and went on to use these techniques to obtain a complete data set from crystals of the synaptotagmin-1 / SNARE complex and to determine the structure at 3.5 Å resolution (Zhou et al., 2015). Here, we describe new advances in our methods and present a reprocessed XFEL data set of the synaptotagmin-1 / SNARE complex. The reprocessing produced small improvements in electron density maps and the refined atomic model. The maps also contained more information than those of a lower resolution (4.1 Å) synchrotron data set. Processing a set of simulated XFEL diffraction images revealed that our methods yield accurate data and atomic models. DOI: http://dx.doi.org/10.7554/eLife.18740.001 eLife Sciences Publications, Ltd 2016-10-12 /pmc/articles/PMC5094853/ /pubmed/27731796 http://dx.doi.org/10.7554/eLife.18740 Text en © 2016, Lyubimov et al http://creativecommons.org/licenses/by/4.0/ This article is distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0/) , which permits unrestricted use and redistribution provided that the original author and source are credited.
spellingShingle Biophysics and Structural Biology
Lyubimov, Artem Y
Uervirojnangkoorn, Monarin
Zeldin, Oliver B
Zhou, Qiangjun
Zhao, Minglei
Brewster, Aaron S
Michels-Clark, Tara
Holton, James M
Sauter, Nicholas K
Weis, William I
Brunger, Axel T
Advances in X-ray free electron laser (XFEL) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / SNARE complex
title Advances in X-ray free electron laser (XFEL) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / SNARE complex
title_full Advances in X-ray free electron laser (XFEL) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / SNARE complex
title_fullStr Advances in X-ray free electron laser (XFEL) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / SNARE complex
title_full_unstemmed Advances in X-ray free electron laser (XFEL) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / SNARE complex
title_short Advances in X-ray free electron laser (XFEL) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / SNARE complex
title_sort advances in x-ray free electron laser (xfel) diffraction data processing applied to the crystal structure of the synaptotagmin-1 / snare complex
topic Biophysics and Structural Biology
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5094853/
https://www.ncbi.nlm.nih.gov/pubmed/27731796
http://dx.doi.org/10.7554/eLife.18740
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