| Symmetry used in scalepack | p2 |
|---|---|
| a (Angstrom) | 12.1961 +/- 0.0004 |
| b (Angstrom) | 18.6353 +/- 0.0007 |
| c (Angstrom) | 13.4696 +/- 0.0004 |
| alpha (°) | 90.000 |
| beta (°) | 93.802 +/- 0.002 |
| gamma (°) | 90.000 |
| Volume (A**3) | 3054.61 +/- 0.18 |
| Mosaicity (°) | 0.590 +/- 0.002 |
| Total number of images collected | 283 |
|---|---|
| Total exposure time | 17.5 hours |
| Data collection exposure time | 17.3 hours |
| Data collection wall-clock time | 18.0 hours |
| Wavelength | 0.71073 A |
|---|---|
| Cryostat setting | 123.00K |
| Generator setting | 55kV 32mA |
| Type | Name | # images | Total Rotation | Per frame Rotation | Exposure per frame | Detector distance | Used in scaling |
|---|---|---|---|---|---|---|---|
| cell determination | i01f | 10 | 10.0° omega | 1.000° | 60 seconds | 40.00 mm | No |
| data collection | s01f | 66 | 125.4° omega | 1.900° | 228 seconds | 39.80 mm | Yes |
| data collection | s02f | 31 | 58.9° omega | 1.900° | 228 seconds | 39.80 mm | Yes |
| data collection | s03f | 64 | 121.6° omega | 1.900° | 228 seconds | 39.80 mm | Yes |
| data collection | s04f | 65 | 123.5° omega | 1.900° | 228 seconds | 39.80 mm | Yes |
| data collection | s05f | 47 | 89.3° omega | 1.900° | 228 seconds | 39.80 mm | Yes |
| Rejected | 43 |
|---|---|
| Overload or incomplete profile | 1244 |
| Sigma cutoff | 28 |
| High resolution limit | 234 |
| Scale factor range | 9.83-10.74 |
|---|---|
| Number of 'full' reflections | 22009 |
| Number of 'partial' reflections | 16834 |
| Total number of integrated reflections | 37321 |
| Total number of unique reflections | 5743 |
| Data completeness | 100.0% |
| Resolution range | 20.36-0.83 A |
| Theta range | 1.00°-25.35° |
| Average Intensity | 20.7 |
| Average Sigma(I) | 1.4 |
| Overall R-merge (linear) | 0.102 |