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. 2014 May 24;70(Pt 6):800–802. doi: 10.1107/S2053230X1400908X

Table 2. Data collection and processing.

Values in parentheses are for the outer shell.

Diffraction source Beamline BL13B1, NSRRC
Wavelength (Å) 1.0
Temperature (K) 100
Detector MX300HE
Crystal-to-detector distance (mm) 300
Rotation range per image (°) 0.4
Total rotation range (°) 120
Exposure time per image (s) 15
Space group P212121
a, b, c (Å) 85.64, 106.11, 145.55
α, β, γ (°) 90, 90, 90
Mosaicity (°) 0.42–0.49
Resolution range (Å) 25.0–2.15 (2.23–2.15)
Total No. of reflections 339445 (34740)
No. of unique reflections 70570 (6948)
Completeness (%) 99.9 (99.8)
I/σ(I)〉 20.7 (5.3)
R merge (%) 9.2 (37.7)
Overall B factor from Wilson plot (Å2) 35.5

R merge = Inline graphic Inline graphic.