Table 1. Data-collection statistics.
Statistics in parentheses are for the highest resolution bin (2.7–2.8 Å).
| SeMet replacement | ||||
|---|---|---|---|---|
| Native | Edge | Peak | Remote | |
| Data collection | APS-19BM | NSLS-X29 | NSLS-X29 | NSLS-X29 |
| Wavelength used (Å) | 0.97919 | 0.97938 | 0.97919 | 0.96408 |
| Data-collection temperature (K) | 110 | 110 | 110 | 110 |
| Space group | P212121 | P212121 | ||
| Unit-cell parameters (Å, °) | a = 46.07, b = 119.61, c = 132.90, α = β = γ = 90 | a = 45.70, b = 119.05, c = 132.51, α = β = γ = 90 | ||
| Resolution range (Å) | 25.0–2.7 | 30.0–3.0 | 30.0–3.0 | 30.0–3.0 |
| No. of unique reflections | 19520 | 15084 | 15136 | 15109 |
| Total No. of reflections | 144379 | 89659 | 124244 | 108891 |
| Redundancy | 6.9 | 5.1 | 6.5 | 5.8 |
| Completeness (%) | 97.9 (99.5) | 99.3 (94.3) | 99.7 (97.8) | 99.4 (94.3) |
| Rmerge† | 0.059 (0.379) | 0.117 (0.335) | 0.098 (0.237) | 0.120 (0.332) |
| 〈I/σ(I)〉 | 24.9 (4.2) | 12.8 (3.8) | 14.8 (5.2) | 13.4 (4.1) |
†
R
merge = 
.