Table 2. Electron-density map correlation coefficients.
Electron-density maps were recalculated using fixed 300 × 300 × 300 grids for the calculation of correlation coefficients to avoid interpolation errors. We re-ran noncrystallographic symmetry averaging using matrices and masks derived at 3.1 Å resolution as well as using matrices and masks derived at 2.5 Å resolution. The experimental maps are calculated using unweighted 2F obs − F ave as coefficients and phases derived from averaged maps.
Correlation coefficient (%) | ||
---|---|---|
3.1 Å experimental versus 2.5 Å experimental phases | ||
3.1 Å map | 3.1 Å map | 68.9 |
3.1 Å map | 2.8 Å map | 66.1 |
3.1 Å map | 2.5 Å map | 64.5 |
2.5 Å experimental versus 2.5 Å experimental phases | ||
3.1 Å map | 2.8 Å map | 94.2 |
3.1 Å map | 2.5 Å map | 91.3 |
2.8 Å map | 2.5 Å map | 93.6 |
2.5 Å experimental versus 2.5 Å calculated phases† | ||
2.5 Å map | 2.5 Å map | 76.8 |
3.1 Å map | 3.1 Å map | 74.8 |
3.1 Å map | 2.5 Å map | 78.7 |
Amplitudes and phases for weighted 2F obc − F calc maps were prepared by the refinement program REFMAC, where F calc are the calculated structure factors from final refined atomic model.