Table I.
Diffraction data analysis, space group P21212
Parameter | Crystal I | Crystal II | Combined |
---|---|---|---|
a (Å) | 111.00 | 111.42 | 111.21 |
b (Å) | 51.32 | 51.12 | 51.28 |
c (Å) | 76.91 | 77.22 | 77.11 |
Resolution (Å) | |||
Total | 30.00–2.65 | 20.00–2.25 | 20.00–2.20 |
Outer shell | 2.77–2.65 | 2.35–2.25 | 2.30–2.20 |
Completeness (%) | 97.4/95.9 | 85.4/85.2 | 96.7/83.8 |
Completeness I/σ>3 (%) | 83.2/59.2 | 72.2/55.6 | 76.9/48.4 |
Rsym (%) | 6.9/28.0 | 5.0/24.9 | 14.2/41.6 |