Table 1.
Data collection | |
---|---|
Space group | C2 |
Cell dimensions a, b, c (Å), β (°) | 98.40, 66.66, 76.93, 122.3 |
Wavelength (Å) | 0.9785 Å |
Resolution (last shell; Å) | 42.0–1.80 (1.86-1.80) |
Unique reflections | 37,768 (3,643) |
Completeness (%) | 97.3 (94.7) |
R-merge | 0.061 (0.248) |
I/σ(I) | 42.7 (4.6) |
Refinement | |
Working set reflections | 35,877 |
Test set reflections (5 %) | 1,886 |
No. protein / DNA / H2O / Na+ | 2,169 / 486 / 167 / 1 |
R-work / R-free (5%) | 0.215 / 0.241 |
Average B-factors (Å2) | |
Protein / DNA / solvent | 30. 9 / 29.4 / 37.3 |
R.m.s. deviations | |
bond lengths (Å) | 0.016 |
bond angles (°) | 1.7 |
Values in parentheses refer to the last resolution shell.