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. 2015 Aug 20;24(10):1649–1659. doi: 10.1002/pro.2760

Table 1.

Space group P21 P1
Unit-cell parameters (Å°) a=54.33, b=37.40, c=65.48, α=90, β=98.57, γ=90 a=35.20, b=62.42, c=66.05, α=72.39, β=74.57, γ=73.63
Resolution (Å) 15.00–1.98 (2.01–1.98) 48.68–2.63 (2.70–2.63)
Completeness (%) 99.5 (99.9) 97.0 (94.3)
Redundancy 3.4 (3.4) 4.7 (4.4)
<I/σ(I)> 19.1 (2.0) 14.2 (3.4)
Rmerge 0.049 (0.58) 0.088 (0.373)
Reflections in working set 17316 (1142) 13737 (676)
Reflections in test set 887 (58) 732 (56)
Rwork/Rfree 0.218/0.247 0.235/0.275
Contents of asymmetric unit 1 Protein:DNA complex 2 Protein:DNA complexes
Number of atoms
Protein 756 1512
DNA 814 1628
Ligand/ion 7 14
Water 93 0
B factors (Å2)
Protein 53 62
DNA 60 69
Ligand/ion 62 67
Water 34 N/A
R.m.s.d bond lengths (Å) 0.005 0.004
R.m.s.d bond angles (°) 1.08 0.92
Ramachandran plot
Favored (%) 96.7 97.3
Disallowed (%) 0.0 0.0
Refinement program REFMAC5 REFMAC5
PDB code 3VD6 3VEK

Values in parentheses are for highest-resolution shell.

Inline graphic.