Table 5. Comparison of data with reduced statistics (60 frames).
| EVAL, Monte Carlo | EVAL, partiality corrected | |||
|---|---|---|---|---|
| Consecutive stills | Random stills | Consecutive stills | Random stills | |
| Refinement† | ||||
| R work (%) | 20.7 | 25.6 | 17.3 | 20.7 |
| R free (%) | 25.1 | 32.3 | 21.8 | 26.3 |
| B (2) | 20.9 | 21.6 | 14.3 | 13.8 |
| Average anomalous densities‡ () | ||||
| No. of reflections§ | 862 | 1265 | 2212 | 2166 |
| Met SD | 0.6 | 0.8 | 1.6 | |
| Cys SG | 0.8 | 1.1 | ||
| Cl | ||||
| Na+ | ||||
†
Restraint refinement, individual isotropic B factors, input structure PDB entry 193l.
‡
ANODE with data merged in point group 422. Averaged densities over similar atom types (two for Met SD, eight for Cys SG, 14 for Cl and one for Na+).
§
Selected by SHELXC.