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. 2019 Oct 30;10:2457. doi: 10.3389/fmicb.2019.02457

TABLE 4.

Diffraction data and refinement statistics of the wild-type Chi23.

Parameters Chi23
Diffraction data
Space group P121
Unit cell
a, b, c (Å) 68.62, 87.49, 88.84
α, β, γ (°) 90.00, 95.30, 90.00
Resolution range (Å) 50.00–1.80 (1.86–1.80)a
Redundancy 6.4 (6.5)
Completeness (%) 99.9 (99.9)
Rmerge (%)b 12.8 (31.6)
II 30.3 (10.2)
Refinement statistics
R-factor (%) 21.5
Free R-factor (%) 23.7
RMSD from ideal geometry
Bond lengths (Å) 0.011
Bond angles (°) 1.00
Ramachandran plot (%)
Favored 97.70
Allowed 2.30
Outliers 0
Overall B-factors (Å2) 18.51

aNumbers in parentheses refer to data in the highest resolution shell. bRmerge = ΣhklΣi| I(hkl)i - < I(hkl) > | /ΣhklΣi < I(hkl)i >.