Table 1B.

Statistics of the peak wavelength SAD data set and native data set

Data set	Peak	Native
Wavelength (Å)	0.97938	1.00000
Resolution (Å)	83.3–3.0	83.3–2.2
Redundancy	3.4 (3.1)a	3.7 (3.5)a
Unique reflections	51235 (2600)	57785 (2866)
Completeness (%)	99.6 (99.7)	99.8 (99.7)
I/σ	8.3 (1.5)	15.3 (3.2)
Rsymb (%)	14.9 (74.4)	9.6 (35.3)

^a Numbers in parentheses refer to the highest resolution shell, which is 3.05–3.00 Å for all peak wavelength data set and 2.24–2.20 Å for native data set.

^bR_sym = Σ_hkl Σ_i|I_hkl,i − ≤I>_hkl|/Σ|≤I>_hkl|.