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. 2008 Sep 30;64(Pt 10):933–935. doi: 10.1107/S1744309108027796

Table 1. Data-collection statistics.

Values in parentheses are for the highest resolution shell.

Space group P212121
Unit-cell parameters (Å) a = 64.41, b = 68.28, c = 147.54
Resolution (Å) 44.68–1.70 (1.79–1.70)
Total No. of observations 339168 (50200)
No. of unique observations 71075 (10418)
Multiplicity 4.8 (4.8)
Data completeness (%) 98.5 (99.9)
I/σ(I)〉 12.4 (3.7)
Rmerge 0.091 (0.337)
Rp.i.m. 0.050 (0.201)

R merge = Inline graphic Inline graphic, 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.

See Weiss &, Hilgenfeld (1997).