Table 1. Data-collection statistics.
Values in parentheses are for the highest resolution shell.
| Form II | Form III | |
|---|---|---|
| Resolution (Å) | 15.0–1.8 (1.94–1.80) | 15.0–1.9 (1.97–1.90) |
| Completeness (%) | 99.9 | 93.8 |
| 〈I/σ(I)〉 | 12.7 (4.0) | 12.5 (3.5) |
| No. of measured reflections | 103726 (9670) | 89162 (3792) |
| No. of unique reflections | 21626 (2149) | 17171 (998) |
| No. of reflections >3σ | 15617 (906) | 12961 (354) |
| Rmerge† | 0.075 (0.524) | 0.096 (0.442) |
R
merge =
.