aThe values in parentheses refer to statistics in the highest bin. bRmerge = ∑hkl∑i|Ii(hkl)−|/∑hkl∑iIi(hkl), where Ii(hkl) is the intensity of an observation and is the mean value for its unique refl
Numbers in parentheses refer to values in the highest resolution shell.aRsym = ΣjΣh|Ih,j−Ih>|/ΣjΣhIh> where Ih,j is the jth observation of reflection h, and Ih> is the mean intensity of that reflectio
