Table 1.
PXL2 | |
---|---|
Wavelengh (Å) | 0.9790 |
Resolution range (Å) | 108.37–3.60 (3.71–3.60) |
Space group | P21212 |
Unit-cell | 128.05, 203.42, 68.49 |
90.00,90.00,90.00 | |
Unique reflections | 18571 (2891) |
Completeness (%) | 99.98 (87.2) |
Mean I/sigma (I) | 13.6 (3.2) |
Redundancy | 3.0 (3.1) |
R sym (%) | 15.7 (64.2) |
R work | 0.277 (0.423) |
R free | 0.321 (0.523) |
R.m.s.d (bonds) | 0.006 |
R.m.s.d (angels) | 2.038 |
* where Ii(hkl) is the intensity of the ith observation of reflection hkl and 〈I(hkl)〉 is the average over all observations of reflection hkl