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. 2011 Oct 27;67(Pt 11):1411–1413. doi: 10.1107/S1744309111034580

Table 1. X-ray data-collection statistics.

Values in parentheses are for the highest resolution shell.

Space group I23
Resolution (Å) 40.07–2.98 (3.14–2.98)
Unit-cell parameters (Å, °) a = 98.16, α = β = γ = 90.00
Total reflections 18394 (2571)
Unique reflections 3337 (490)
Completeness (%) 99.7 (99.6)
Rmerge 0.096 (0.474)
I/σ(I)〉 11.2 (3.5)

R merge = Inline graphic Inline graphic, where I i(hkl) is the intensity of the ith observation of reflection hkl and 〈I(hkl)〉 is the average intensity over symmetry-related observations of reflection hkl.