Table 1. Statistics for the native, Pt-derivative and Hg-derivative BxlA diffraction data sets.
Values in parentheses are for the highest resolution shell.
| Native | Pt derivative | Hg derivative | |
|---|---|---|---|
| Space group | C2 | C2 | C2 |
| Unit-cell parameters | |||
| a (Å) | 142.2 | 143.1 | 141.4 |
| b (Å) | 129.5 | 129.8 | 130.1 |
| c (Å) | 101.4 | 101.9 | 100.3 |
| β (°) | 119.8 | 119.9 | 120.2 |
| Resolution range (Å) | 25.58–2.50 (1.71–1.65) | 25.12–2.50 (2.80–2.70) | 23.65–3.60 (3.73–3.60) |
| No. of unique reflections | 55057 | 54773 | 34786 |
| Average redundancy | 3.71 (3.41) | 3.12 (2.96) | 1.95 (1.79) |
| Completeness (%) | 99.9 (98.8) | 97.9 (93.7) | 97.5 (91.5) |
| Rmerge† | 0.083 (0.295) | 0.137 (0.390) | 0.195 (0.437) |
| Average I/σ(I) | 11.6 (3.9) | 6.7 (2.7) | 3.7( 1.7) |
†
R
merge = 
, where Ii(hkl) and 〈I(hkl)〉 are the observed intensity and the mean intensity of related reflections, respectively.