New data analysis for BioSAXS at the ESRF

The second phase of the ESRF upgrade program did not only provide a new storage ring (Extremely Brilliant Source, EBS) but also allowed several beamlines to be refurbished. The BioSAXS beamline (located on port BM29) was upgraded with a new wiggler source and a larger detector. All analysis software...

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Main Authors: Jérôme Kieffer, Martha Brennich, Jean-Baptiste Florial, Marcus Oscarsson, Alejandro De Maria Antolinos, Mark Tully, Petra Pernot
Format: Article
Language:English
Published: International Union of Crystallography 2022-09-01
Series:Journal of Synchrotron Radiation
Subjects:
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600577522007238
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author Jérôme Kieffer
Martha Brennich
Jean-Baptiste Florial
Marcus Oscarsson
Alejandro De Maria Antolinos
Mark Tully
Petra Pernot
author_facet Jérôme Kieffer
Martha Brennich
Jean-Baptiste Florial
Marcus Oscarsson
Alejandro De Maria Antolinos
Mark Tully
Petra Pernot
author_sort Jérôme Kieffer
collection DOAJ
description The second phase of the ESRF upgrade program did not only provide a new storage ring (Extremely Brilliant Source, EBS) but also allowed several beamlines to be refurbished. The BioSAXS beamline (located on port BM29) was upgraded with a new wiggler source and a larger detector. All analysis software has been rewritten to cope with the increased data flux and continues to provide beamline users with reduced and pre-processed data in real time. This article describes FreeSAS, an open-source collection of various small-angle scattering analysis algorithms needed to reduce and analyze BioSAXS data, and Dahu, the tool used to interface data analysis with beamline control. It further presents the data-processing pipelines for the different data acquisitions modes of the beamline, using either a sample changer for individual homogeneous samples or an inline size-exclusion chromatography setup.
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spelling doaj.art-a8e8ef0ebc8b469c94217d5c4bc683b32022-12-22T03:47:37ZengInternational Union of CrystallographyJournal of Synchrotron Radiation1600-57752022-09-012951318132810.1107/S1600577522007238ju5045New data analysis for BioSAXS at the ESRFJérôme Kieffer0Martha Brennich1Jean-Baptiste Florial2Marcus Oscarsson3Alejandro De Maria Antolinos4Mark Tully5Petra Pernot6ESRF – The European Synchrotron, 71 Avenue des Martyrs, 38000 Grenoble, FranceEuropean Molecular Biology Laboratory, 71 Avenue des Martyrs, 38000 Grenoble, FranceEuropean Molecular Biology Laboratory, 71 Avenue des Martyrs, 38000 Grenoble, FranceESRF – The European Synchrotron, 71 Avenue des Martyrs, 38000 Grenoble, FranceESRF – The European Synchrotron, 71 Avenue des Martyrs, 38000 Grenoble, FranceESRF – The European Synchrotron, 71 Avenue des Martyrs, 38000 Grenoble, FranceESRF – The European Synchrotron, 71 Avenue des Martyrs, 38000 Grenoble, FranceThe second phase of the ESRF upgrade program did not only provide a new storage ring (Extremely Brilliant Source, EBS) but also allowed several beamlines to be refurbished. The BioSAXS beamline (located on port BM29) was upgraded with a new wiggler source and a larger detector. All analysis software has been rewritten to cope with the increased data flux and continues to provide beamline users with reduced and pre-processed data in real time. This article describes FreeSAS, an open-source collection of various small-angle scattering analysis algorithms needed to reduce and analyze BioSAXS data, and Dahu, the tool used to interface data analysis with beamline control. It further presents the data-processing pipelines for the different data acquisitions modes of the beamline, using either a sample changer for individual homogeneous samples or an inline size-exclusion chromatography setup.http://scripts.iucr.org/cgi-bin/paper?S1600577522007238biosaxsonline data analysissolution scatteringproteinsbiological small-angle x-ray scatteringautomationhigh brilliancestructural biologyhigh-throughput saxssize-exclusion chromatographyonline purification
spellingShingle Jérôme Kieffer
Martha Brennich
Jean-Baptiste Florial
Marcus Oscarsson
Alejandro De Maria Antolinos
Mark Tully
Petra Pernot
New data analysis for BioSAXS at the ESRF
Journal of Synchrotron Radiation
biosaxs
online data analysis
solution scattering
proteins
biological small-angle x-ray scattering
automation
high brilliance
structural biology
high-throughput saxs
size-exclusion chromatography
online purification
title New data analysis for BioSAXS at the ESRF
title_full New data analysis for BioSAXS at the ESRF
title_fullStr New data analysis for BioSAXS at the ESRF
title_full_unstemmed New data analysis for BioSAXS at the ESRF
title_short New data analysis for BioSAXS at the ESRF
title_sort new data analysis for biosaxs at the esrf
topic biosaxs
online data analysis
solution scattering
proteins
biological small-angle x-ray scattering
automation
high brilliance
structural biology
high-throughput saxs
size-exclusion chromatography
online purification
url http://scripts.iucr.org/cgi-bin/paper?S1600577522007238
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