Operational properties of fluctuation X-ray scattering data

X-ray scattering images collected on timescales shorter than rotation diffusion times using a (partially) coherent beam result in a significant increase in information content in the scattered data. These measurements, named fluctuation X-ray scattering (FXS), are typically performed on an X-ray fre...

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Main Authors: Erik Malmerberg, Cheryl A. Kerfeld, Petrus H. Zwart
Format: Article
Language:English
Published: International Union of Crystallography 2015-05-01
Series:IUCrJ
Subjects:
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2052252515002535
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author Erik Malmerberg
Cheryl A. Kerfeld
Petrus H. Zwart
author_facet Erik Malmerberg
Cheryl A. Kerfeld
Petrus H. Zwart
author_sort Erik Malmerberg
collection DOAJ
description X-ray scattering images collected on timescales shorter than rotation diffusion times using a (partially) coherent beam result in a significant increase in information content in the scattered data. These measurements, named fluctuation X-ray scattering (FXS), are typically performed on an X-ray free-electron laser (XFEL) and can provide fundamental insights into the structure of biological molecules, engineered nanoparticles or energy-related mesoscopic materials beyond what can be obtained with standard X-ray scattering techniques. In order to understand, use and validate experimental FXS data, the availability of basic data characteristics and operational properties is essential, but has been absent up to this point. In this communication, an intuitive view of the nature of FXS data and their properties is provided, the effect of FXS data on the derived structural models is highlighted, and generalizations of the Guinier and Porod laws that can ultimately be used to plan experiments and assess the quality of experimental data are presented.
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spelling doaj.art-7c3f7b756ebb454cb0469613a2dfc3e72022-12-21T23:49:53ZengInternational Union of CrystallographyIUCrJ2052-25252015-05-012330931610.1107/S2052252515002535dc5005Operational properties of fluctuation X-ray scattering dataErik Malmerberg0Cheryl A. Kerfeld1Petrus H. Zwart2Physical Biosciences Division, Lawrence Berkeley National Laboratory, Berkeley, California, USAPhysical Biosciences Division, Lawrence Berkeley National Laboratory, Berkeley, California, USAPhysical Biosciences Division, Lawrence Berkeley National Laboratory, Berkeley, California, USAX-ray scattering images collected on timescales shorter than rotation diffusion times using a (partially) coherent beam result in a significant increase in information content in the scattered data. These measurements, named fluctuation X-ray scattering (FXS), are typically performed on an X-ray free-electron laser (XFEL) and can provide fundamental insights into the structure of biological molecules, engineered nanoparticles or energy-related mesoscopic materials beyond what can be obtained with standard X-ray scattering techniques. In order to understand, use and validate experimental FXS data, the availability of basic data characteristics and operational properties is essential, but has been absent up to this point. In this communication, an intuitive view of the nature of FXS data and their properties is provided, the effect of FXS data on the derived structural models is highlighted, and generalizations of the Guinier and Porod laws that can ultimately be used to plan experiments and assess the quality of experimental data are presented.http://scripts.iucr.org/cgi-bin/paper?S2052252515002535fluctuation X-ray scatteringXFELSbiological moleculesnanoparticlesmesoscopic materials
spellingShingle Erik Malmerberg
Cheryl A. Kerfeld
Petrus H. Zwart
Operational properties of fluctuation X-ray scattering data
IUCrJ
fluctuation X-ray scattering
XFELS
biological molecules
nanoparticles
mesoscopic materials
title Operational properties of fluctuation X-ray scattering data
title_full Operational properties of fluctuation X-ray scattering data
title_fullStr Operational properties of fluctuation X-ray scattering data
title_full_unstemmed Operational properties of fluctuation X-ray scattering data
title_short Operational properties of fluctuation X-ray scattering data
title_sort operational properties of fluctuation x ray scattering data
topic fluctuation X-ray scattering
XFELS
biological molecules
nanoparticles
mesoscopic materials
url http://scripts.iucr.org/cgi-bin/paper?S2052252515002535
work_keys_str_mv AT erikmalmerberg operationalpropertiesoffluctuationxrayscatteringdata
AT cherylakerfeld operationalpropertiesoffluctuationxrayscatteringdata
AT petrushzwart operationalpropertiesoffluctuationxrayscatteringdata