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. 2017 Apr 10;114(17):4400–4405. doi: 10.1073/pnas.1703066114

Table S1.

X-ray data collection and refinement statistics

Statistic Value
Data collection
 Space group P65
 Cell dimensions
  a, b, c, Å 78.92, 78.92, 139.40
   α, β, γ, ° 90.00, 90.00, 120.00
 Resolution, Å 50.00–2.30 (2.38–2.30)*
 Rsym 0.118 (0.481)
 Avg. II 29.1 (7.0)
 Completeness, % 96.2 (100.0)
 Redundancy 12.3 (12.6)
 Wilson B-factor, Å2 21.8
Refinement
 Resolution, Å 39.47–2.30 (2.42–2.30)
 No. of reflections 20,828 (3,014)
 Rwork 0.157 (0.170)
 Rfree 0.201 (0.220)
 No. of atoms
  Protein 2,882
  Water 245
 Avg. B-factors,§, Å2
  Protein 25.0
  Water 27.6
 rmsd
  Bond lengths, Å 0.003
  Bond angles, ° 0.769
 Ramachandran distribution, %
  Favored 98.1
  Allowed 1.9
  Disallowed 0.0
*

Statistics for the highest-resolution shell are shown in parentheses.

Rfree was determined from the 5% of reflections excluded from refinement.

Riding hydrogens were not included in the number of atoms or average B-factors.

§

Equivalent isotropic B-factors were calculated in conjunction with TLS-derived anisotropic B-factors.