遇见数据集

X-ray Data and Refinement Statistics.

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aValues in parentheses refer to statistics in the highest-resolution shell. bRmerge = Σ|Iobs−|/ΣIobs. cFigure of merit = |Fbest|/|F|. dR = Σ|Fobs-Fcalc| / ΣFobs, where Fobs and Fcalc are the observed and calculated structure-factor amplitudes, respectively. eRfree was computed using 5% of the data assigned randomly. fRoot mean square deviation. gEstimated standard uncertainties based on maximum likelihood.

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2012-10-31
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