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. 2012 Nov 14;68(Pt 12):1440–1447. doi: 10.1107/S1744309112043394

Table 1. Experimental setup and statistics of data collection and processing.

Values in parentheses are for the highest resolution shell.

Space group P212121
Radiation source National Research Center ‘Kurchatov Institute’
Unit-cell parameters (Å) a = 76.950, b = 85.600, c = 105.960
Temperature (K) 100
Wavelength (Å) 0.800
Crystal-to-detector distance (mm) 410
Oscillation range (°) 0.5
Mosaicity (°) 0.20
No. of frames 720
Resolution limit (Å) 29.26–3.02 (3.20–3.02)
Total reflections 68411 (10505)
Molecules per asymmetric unit 1
Solvent content (%) 55
Independent reflections 13339 (2121)
Average I/σ(I) 14.19 (1.75)
Completeness (%) 93.3 (94.0)
R merge 0.10 (0.66)