Journal
NATURE METHODS
Volume 10, Issue 11, Pages 1102-1104Publisher
NATURE PUBLISHING GROUP
DOI: 10.1038/NMETH.2648
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Funding
- US National Institutes of Health [GM063210, GM092802]
- US Department of Energy [DE-AC02-05CH11231]
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Refinement of macromolecular structures against low-resolution crystallographic data is limited by the ability of current methods to converge on a structure with realistic geometry. We developed a low-resolution crystallographic refinement method that combines the Rosetta sampling methodology and energy function with reciprocal-space X-ray refinement in Phenix. On a set of difficult low-resolution cases the method yielded improved model geometry and lower free R factors than alternate refinement methods.
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