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. 2016 Jul 29;11(7):e0160186. doi: 10.1371/journal.pone.0160186

Table 1. Data Collection and Refinement Statistics.

Data Collection and Processing
Beamline I04-I
Wavelength (Å) 0.9174
Resolution (Å) 32.4–1.9 (2.0–1.9)
Space group C 2 2 2
Unit cell parameters a = 109.67Å b = 177.51Å c = 76.37Å α = 90° β = 90° γ = 90°
Unique reflections 58733 (8465)
Completeness (%) 99.6 (99.6)
Mn(I)/sd(I) 15.3 (3.0)
Multiplicity 6.2 (6.3)
Rmerge 0.081 (0.669)
Refinement
Rwork/Rfreea 0.1571/0.2046
Molecules in ASU 1
Average B-factor, all atoms (Å2) 28.0
r.m.s.d. Bond lengths (Å) 0.031
r.m.s.d. Bond angles (°) 2.71
Ramachandran distribution (%)b 96.9/2.7/0.4

Values for the highest resolution shell given in parenthesis

a Rfree calculated from 5% reflections omitted from structure refinement

b Favoured/Permitted/Disallowed