Table 2.
Data Collection Statisticsa
| LdtAb | Iodide-LdtAb | |
|---|---|---|
| resolution (Å) | 37.1–2.6 (2.72–2.60) | 38.0–3.2 (3.42–3.20) |
| reflections, observed/unique | 113592/16048 | 714128/9200 |
| R meas b | 11.1 (112.6) | 46.6 (284.0) |
| R pim b | 4.1 (42.0) | 5.2 (32.6) |
| I/σI | 10.3 (1.9) | 15.5 (3.4) |
| completeness (%) | 99.8 (98.8) | 99.6 (99.3) |
| CC1/2c | 0.999 (0.932) | 0.998 (0.961) |
| average multiplicity | 7.1 (7.0) | 77.6 (74.1) |
| Wilson B (Å2) | 67.0 | 103.0 |
| anomalous multiplicity | – | 41.6 (38.8) |
| CCanomd |
– | 0.494 |
| MSANe | – | 1.288 |
a
Numbers in parentheses refer to the highest resolution shell.
b
Rmeas is the redundancy-independent merging R factor. Rpim is the precision-indicating merging R factor.62
c
Correlation between intensities from random half-sets of data.63
d
Correlation of ΔIanom from two random half-sets.64
e
Midslope of the anomalous normal probability plot. Values > 1 indicate significant anomalous signal.62