Data-collection and refinement statistics.
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Values in parentheses are for the outermost shell.†Rmerge = ∑hkl ∑i |Ii(hkl)−I(hkl)>|/∑hkl ∑i Ii(hkl), where Ii(hkl) is the ith observation of reflection hkl and I(hkl)> is the weighted average intensity for all observations i of reflection hkl.§Rcryst = ∑hkl ||Fobs|−|Fcalc||/∑hkl |Fobs|, where |Fobs| and |Fcalc| are the observed and calculated structure-factor amplitudes, respectively. Rfree was calculated with 5% of the reflections chosen at random and omitted from refinement.
创建时间：
2015-12-02
