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. 2013 Apr 11;69(Pt 5):830–837. doi: 10.1107/S0907444913002023

Table 1. Data-collection and refinement statistics for Deg5 (S266A) and Deg8 (S292A).

  Deg5 (S266A) Deg8 (S292A)
Data collection
 Space group C2 C2
 Unit-cell parameters (Å, °) a = 109.1, b = 126.0, c = 83.3, β = 102.9 a = 129.5, b = 124.2, c = 93.3, β = 132.4
 Resolution range (Å) 50–2.6 (2.69–2.60) 50–2.0 (2.07–2.00)
 No. of reflections (total/unique) 33072/11024 73478/9929
 〈I/σ(I)〉 10.9 (2.3) 25.2 (4.3)
 Completeness (%) 99.2 (97.8) 99.3 (100.0)
 Multiplicity (%) 3.0 (2.9) 7.4 (7.7)
 Wilson B factor (Å2) 50.2 37.5
R merge (%) 9.4 (46.5) 6.7 (47.8)
Structure refinement
 Resolution (Å) 80–2.6 30–2.0
R work 0.182 0.198
R free 0.231 0.235
 Ramachandran plot (%)
  Favoured region 93.1 96.4
  Allowed region 6.1 3.4
  Outlier region 0.8 0.2
 R.m.s.d. bonds (Å) 0.007 0.007
 R.m.s.d. angles (°) 1.026 1.122
 Mean B value (Å2) 51.7 51.8