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. 2022 Nov 28;78(Pt 12):408–415. doi: 10.1107/S2053230X22010937

Table 3. Data collection and processing.

Values in parentheses are for the highest resolution shell.

Diffraction source Rigaku FR-X rotating anode
Wavelength (Å) 1.5418
Temperature (K) 100
Detector Rigaku R-AXIS VII image plate
Crystal-to-detector distance (mm) 120
Rotation range per image (°) 0.5
Total rotation range (°) 135
Exposure time per image (s) 60
Space group P41212
a, b, c (Å) 61.32, 61.32, 208.57
α, β, γ (°) 90, 90, 90
Mosaicity (°) 0.229
Resolution range (Å) 50.00–1.65 (1.75–1.65)
Total No. of reflections 425548 (32429)
No. of unique reflections 47616 (6313)
Completeness (%) 96.8 (81.0)
Multiplicity 8.9 (5.1)
I/σ(I)〉 23.4 (6.4)
CC1/2 0.999 (0.956)
R meas 0.063 (0.222)
R p.i.m. 0.024 (0.128)
Overall B factor from Wilson plot (Å2) 21.7