Table 1. Data collection and processing.
Values in parentheses are for the outer shell.
| Apo DnmZ | dTDPDnmZ | |
|---|---|---|
| Diffraction source | Beamline 12-2, SSRL | Beamline 12-2, SSRL |
| Wavelength () | 0.95370 | 0.97950 |
| Temperature (K) | 100 | 100 |
| Detector | Dectris PILATUS 6M | Dectris PILATUS 6M |
| Crystal-to-detector distance (mm) | 650 | 605 |
| Rotation range per image () | 0.2 | 0.15 |
| Total rotation range () | 90 | 180 |
| Exposure time per image (s) | 1 | 0.5 |
| Space group | P212121 | P212121 |
| a, b, c () | 99.84, 134.49, 142.92 | 100.48, 134.67, 144.29 |
| , , () | 90, 90, 90 | 90, 90, 90 |
| Mosaicity () | 0.7 | 0.3 |
| Resolution range () | 48.93.00 (3.113.00) | 39.432.74 (2.882.74) |
| Total No. of reflections | 123512 (11591) | 325167 (33667) |
| No. of unique reflections | 38251 (3691) | 51414 (6704) |
| Completeness (%) | 97.8 (95.3) | 98.2 (88.9) |
| Multiplicity | 3.2 (3.1) | 6.3 (5.0) |
| I/(I) | 17.5 (2.3) | 32.9 (4.1) |
| R r.i.m. † (%) | 7.6 (56.5) | 4.5 (39.1) |
| Overall B factor from Wilson plot (2) | 97.06 | 74.36 |
†
The redundancy-independent merging R factor R r.i.m. was estimated by multiplying the conventional R merge value by the factor [N/(N 1)]1/2, where N is the data multiplicity.