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. 2008 Apr 24;64(Pt 5):398–401. doi: 10.1107/S1744309108007240

Table 1. Data-collection and processing statistics.

Values in parentheses are for the highest resolution shell.

Source Beamline X13, EMBL, Hamburg
Space group P42
Unit-cell parameters (Å) a = 123.0, b = 123.0, c = 174.6
Temperature (K) 120
Wavelength (Å) 0.8088
Crystal-to-detector distance (mm) 180
Resolution limit (Å) 25–2.1 (2.18–2.10)
Exposure time per image (s) 140
No. of observed reflections 669724
No. of unique reflections 151083
Average redundancy 4.4 (4.0)
Completeness (%) 99.7 (100)
Mean I/σ(I) 18.09 (3.32)
Rmerge (%) 8.1 (42.9)
No. of molecules in ASU 12
Matthews coefficient (Å3 Da−1) 2.89
Solvent content (%) 58

R merge = Inline graphic Inline graphic, where Ii(hkl) is the intensity of an individual measurement of the reflection with Miller indices hkl and 〈I(hkl)〉 is the mean intensity of redundant measurements of that reflection.