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. 2019 Dec 16;15(12):e1008165. doi: 10.1371/journal.ppat.1008165

Table 1. Crystallographic data collection and model refinement statistics.

Space group C 1 2 1
Unit cell parameters a, b, c (Å) 80.18, 71.82, 87.69
Unit cell parameters α, β, γ (°) 90, 110.09, 90
Resolution (Å) 50.0–2.02 (2.05–2.02)1
No. of reflections collected 110034
No. of unique reflections 29777 (1161)
CC1/2 0.968 (0.838)
CC* 0.992 (0.955)
Mean I/σI 15.36 (1.71)
Rpim 0.063 (0.321)
Completeness (%) 96.2 (75.5)
Redundancy 3.7 (2.0)
Rwork/ Rfree (%) 21.84 / 27.19 (32.16 / 35.72)
Number of protein atoms (non-hydrogen) 3210
Number of solvent atoms (non-hydrogen) 100
Average B value for protein atoms (Å2) 69.71
Average B value for solvent atoms (Å2) 50.66
RMSD bond lengths (Å) 0.003
RMSD bond angles (º) 0.690
Clashscore 6.59
Ramachandran favored (%) 91.9
Ramachandran outliers (%) 1.7

1Values in parentheses correspond to the highest resolution shell.