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. 2016 Apr 22;72(Pt 5):376–381. doi: 10.1107/S2053230X16005707

Table 3. Data-collection and processing statistics for lsBSH.

Values in parentheses are for the outer shell.

Diffraction source Rigaku F-RE++
Wavelength (Å) 1.5418
Temperature (K) 100
Detector Saturn 944 CCD
Crystal-to-detector distance (mm) 50
Rotation range per image (°) 0.75
Total rotation range (°) 150
Exposure time per image (s) 30
Space group P21212
a, b, c (Å) 90.79, 87.36, 86.77
α, β, γ (°) 90, 90, 90
Mosaicity (°) 0.695
Resolution range (Å) 50.0–1.90 (1.93–1.90)
Total No. of reflections 312064
No. of unique reflections 54757
Completeness (%) 99.3 (90.0)
Multiplicity 5.7 (3.6)
I/σ(I)〉 28.9 (4.91)
R r.i.m. 0.060 (0.278)
Overall B factor from Wilson plot (Å2) 13.0