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. 2002 Feb 1;30(3):719–725. doi: 10.1093/nar/30.3.719

Table 1. Crystal details, data collection and final refinement parameters.

Unit cell dimensions (Å) a = b = 30.2, c = 39.3
Space group P64
No. of observations 30 670
No. of unique reflections 1955
Resolution range (Å) 40–1.8
Rmerge (%) 9.4 (35.1)a
Completeness (%) 99.8 (100)a
II 21.5 (5.0)a
No. of water molecules 17 full occupancy and three partial occupancy
R (%) 21.9
Rfree (%) 29.1
RMSD from ideal geometry of final model distances  
 Bonds (Å) 0.004 (0.03)b
 Angles (Å) 0.012 (0.05)b
 Planes (Å) 0.027 (0.10)b
Average B values (Å2)  
 Bases 25
 Sugars 28
 Phosphates 32
 Intercalated ligand (100% occupancy) 29
 Intercalated ligand side chain (66% occupancy) 49
 End-stacked ligand (50% occupancy) 26
 Water  
  Full occupancy 34
  Partial occupancy 43

aValues in parentheses are for the last shell, 1.86–1.80 Å.

bTarget values are in parentheses.