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. 2011 Jan 19;39(10):4419–4426. doi: 10.1093/nar/gkr015

Table 1.

Crystallographic statistics for a DNA containing Ç

Space group P212121
Unit cell a = 24.71 Å, b = 44.55 Å, c = 45.94 Å; α = β = γ = 90°
Vm 1.95 Å3/Daa
Solvent content 57.4%
Resolution 50–1.7 Å (1.74–1.70 Å)b
I/σ 54.0 (20.0)
Completeness 94.3% (82.9%)
Rmerge 0.022 (0.070)
Multiplicity 8.4 (6.4)
Reflections 5613 (354)
Refinement
Rcryst 15.9% (0.138)
Rfree 19.5% (0.218)
 Mean B-factor 14.5 Å2
Number of atoms
    DNA 436
    Solvent 83
    Total 519

aMatthews co-efficient and solvent content calculated based on a predicted duplex DNA MW of 6494 Da.

bValues in parenthesis indicated highest of 20 resolution bins for data reduction and highest of four resolution bins for refinement.