five

Data collection and refinement statistics.

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https://figshare.com/articles/dataset/_Data_collection_and_refinement_statistics_/764579
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资源简介:
Values in parentheses are for the highest resolution shell. aRmerge = ∑hkl ∑i |Ihkl,i - [Ihkl]|/∑hkl ∑i Ihkl,i, where [Ihkl] is the is the average of symmetry related observations of a unique reflection. bRwork = ∑|Fobs-Fcalc|/∑Fobs, where Fobs and Fcalc are the observed and the calculated structure factors, respectively. cRfree is R using 5% (apo) or 10% (complex) of reflections randomly chosen and omitted from refinement.
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2013-08-05
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