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. 2019 Jul 23;39(7):BSR20191292. doi: 10.1042/BSR20191292

Table 1. Refinement statistics for crystal structure.

Space group I4
Unit cell (Å) a = b = 102.635 c = 103.392
Resolution (Å) (highest resolution bin) 20.06–2.30 (2.42–2.30)
Protein residues (atoms) chain A / B 148 (1254) / 143 (1201)
Water molecules 147
Stearic acid / Tris residues 1 / 2
Rwork (%) 18.57
Rfree (%) 23.15
R.m.s.d. bond lengths (Å) / angles (°) 0.01 / 1.09
Average isotropic thermal parameters (Å)
  Main chain (side chain) atoms Chain A/B 41.24 (48.52) / 42.00 (48.46)
  Water molecules 50.60
  Stearic acid / Tris 50.74 / 58.84
Ramachandran analysis
  % Favoured regions 99.3
  % Outliers 0