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. 2014 Nov 14;70(Pt 12):1671–1674. doi: 10.1107/S2053230X14024388

Table 1. X-ray diffraction data-collection and processing statistics.

Values in parentheses are for the outermost shell.

Space group P1211
Wavelength () 0.9792
Resolution range () 50.002.85 (2.902.85)
Unit-cell parameters (, ) a = 46.82, b = 140.19, c = 81.94, = 90.00, = 92.00, = 90.00
No. of molecules in asymmetric unit 1
No. of observed reflections 151857
No. of unique reflections 22194
I/(I) 11.72 (2.69)
Completeness (%) 89.9 (79.1)
R merge (%) 17.4 (57.2)

R merge = Inline graphic Inline graphic, where I(hkl) is the mean of the i observations Ii(hkl) of reflection hkl.