five

Data collection and refinement statistics*.

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Figshare2015-12-02 更新2026-04-29 收录
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*The data set was collected from one single crystal. Values in parentheses are for the highest resolution shell.†Rmerge = ∑hkl∑I |Ii(hkl) − (hkl)>|/∑hkl∑iIi(hkl), where Ii(hkl) is the intensity of the ith observation of the reflection hkl and (hkl)> is the mean intensity of reflections hkl.§Rwork = ∑(||F(obs)| − |F(calc)||)/∑|F(obs)|, where F(obs) and F(calc) are observed and calculated structure factors, respectively.¶Rfree was calculated using 5% of data excluded from refinement.
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2015-12-02
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