Journal
NATURE METHODS
Volume 11, Issue 5, Pages 545-548Publisher
NATURE PUBLISHING GROUP
DOI: 10.1038/NMETH.2887
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Funding
- US National Institutes of Health (NIH) [GM095887, GM102520]
- NIH [GM055302, P41GM103393]
- LCLS
- Atomic, Molecular and Optical Science program, CSGB Division, OBES, DOE
- SLAC National Accelerator Laboratory Directed Research and Development program
- Artificial Leaf Project Umea (K&A Wallenberg Foundation)
- Solar Fuels Strong Research Environment Lima (Umea University)
- Vetenskapsradet and Swedish Energy Agency (Energimyndigheten)
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X-ray free-electron laser (XFEL) sources enable the use of crystallography to solve three-dimensional macromolecular structures under native conditions and without radiation damage. Results to date, however, have been limited by the challenge of deriving accurate Bragg intensities from a heterogeneous population of microcrystals, while at the same time modeling the X-ray spectrum and detector geometry. Here we present a computational approach designed to extract meaningful high-resolution signals from fewer diffraction measurements.
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