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. 2020 Feb 3;76(Pt 2):47–57. doi: 10.1107/S2053230X20000199

Table 1. Data-collection statistics.

Values in parentheses are for the outer shell.

Space group P3121
Unit-cell parameters
a (Å) 75.46
b (Å) 75.46
c (Å) 94.23
Wavelength (Å) 1.5418
Unique reflections 15843 (2151)
Resolution range (Å) 53.70–2.21 (2.33–2.21)
Completeness (%) 99.2 (94.2)
Multiplicity 7.3 (7.0)
Mean I/σ(I) 23.8 (5.9)
R merge (%) 0.067 (0.322)
Average mosaicity (°) 0.62

R merge = Inline graphic Inline graphic, where I i(hkl) is the ith measurement of the intensity of reflection hkl and 〈I(hkl)〉 is the mean intensity of reflection hkl.