Improved chemistry restraints for crystallographic refinement by integrating the Amber force field into Phenix

Moriarty, N.W.; Janowski, P.A.; Swails, J.M.; Nguyen, H.; Richardson, J.S.; Case, D.A.; Adams, P.D.

doi:10.1107/S2059798319015134

Acta Crystallographica Section D
Acta Crystallographica
Section D STRUCTURAL BIOLOGY

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Figure 4
Fraction of C^β deviations (in %) per C^β atom as a function of resolution for the CDL/E&H (dark blue) and Amber (burnt orange) refinements. Values are averaged in each bin of resolution, with the error bars showing the 95% confidence level of the standard error of the mean.

STRUCTURAL
BIOLOGY

ISSN: 2059-7983

Volume 76| Part 1| January 2020| Pages 51-62

https://doi.org/10.1107/S2059798319015134

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