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. 2016 Aug 18;72(Pt 9):1026–1035. doi: 10.1107/S2059798316012079
  LUX–DNA Urease
  All GA HCA All GA HCA
No. of sub-data sets 204 36 77 127 39 79
HCA CC cutoff 0.75 0.8
GA population size 25 20
GA generations 300 250
GA R weight 1 1
GA I weight 2.5 3
GA CC1/2 weight 1 2
GA groups 3 3
Data sets in common between GA and HCA 26 34
Sub data-set R meas,inner 15.3 (18.9) 5.2 (3.0) 6.5 (3.4)
Sub data-set 〈I/σ(I)〉inner 10.9 (6.7) 16.6 (6.2) 14.1 (5.8)
Sub data-set completeness (%) 5.4 (1.2) 5.7 (0.9) 5.8 (0.8) 42.9 (4.9) 43.9 (2.3) 43.5 (3.1)
Resolution range (Å)
 Overall 68.86–2.80 68.86–2.80 68.86–2.80 98.38–2.09 98.38–2.09 98.38–2.09
 Outer shell 2.87–2.80 2.87–2.80 2.87–2.80 2.14–2.09 2.14–2.09 2.14–2.09
Total No. of reflections
 Overall 292976 70083 118205 20341640 5794906 12815153
 Outer shell 16922 4231 7949 749997 182806 608053
No. of unique reflections
 Overall 14499 14224 14024 107644 107603 105577
 Outer shell 1039 928 1000 7320 7016 7173
Completeness (%)
 Inner shell 100.0 94.5 96.2 99.9 99.9 100.0
 Outer shell 100.1 89.3 99.5 100.0 87.5 100.0
 Overall 99.9 98.0 99.4 100.0 99.1 100.0
Multiplicity
 Inner shell 22.6 5.3 9.0 224.3 66.9 146.0
 Outer shell 16.3 4.1 7.9 102.4 22.8 84.8
 Overall 20.2 4.8 8.4 189.0 53.4 121.4
R factor (%)
 Inner shell 71.0 17.0 32.6 93.5 6.7 8.4
 Outer shell 187.0 83.2 141.3 157.8 128.8 145.0
 Overall 74.5 37.0 50.3 86.0 29.8 32.0
R meas (%)
 Inner shell 72.7 18.8 35.1 93.6 6.7 8.4
 Outer shell 192.6 93.5 151.2 158.6 131.3 145.8
 Overall 76.1 41.0 52.9 86.2 30.1 32.2
I/σ(I)〉
 Inner shell 11.8 16.3 11.3 101.1 121.4 102.9
 Outer shell 3.7 5.0 4.8 3.4 2.4 4.2
 Overall 7.8 9.9 7.5 24.9 23.3 25.8
SigAno
 Inner shell 3.16 3.79 3.27
 Outer shell 0.73 0.76 0.73
 Overall 0.99 1.05 1.00
CC1/2 (%)
 Inner shell 93.7 95.0 98.1 99.9 99.6 99.9
 Outer shell 68.1 59.6 44.9 80.5 66.6 92.8
 Overall 94.4 94.3 97.0 99.9 99.8 99.9

Average values; standard deviations are given in parentheses.

Insufficient reflections in the sub-data sets to obtain statistics.