Table 2. Refinement statistics.
Values in parentheses are for the highest of 20 resolution shells.
| PDB code | 3eom | 3eon | 3gnc | 3d6b | 3gqt |
|---|---|---|---|---|---|
| Resolution range (Å) | 30.000–2.398 (2.460–2.398) | 46.630–2.550 (2.616–2.550) | 46.68–2.15 (2.21–2.15) | 47.190–2.210 (2.27–2.21) | 50.0–1.99 (2.04–1.99) |
| No. of reflections above σ cutoff in final cycle | 60090 | 49412 | 81910 | 76240 | 103473 |
| Rcryst | 0.213 | 0.191 | 0.209 | 0.212 | 0.202 |
| No. of reflections for Rfree† | 3035 (212) | 2476 (179) | 4105 (291) | 3826 (222) | 5175 (377) |
| Final Rfree† | 0.264 (0.369) | 0.266 (0.330) | 0.255 (0.332) | 0.261 (0.356) | 0.238 (0.295) |
| Overall average B factor (Å2) | 60.4 | 42.6 | 37.4 | 36.5 | 38.3 |
| Average ligand B factor (Å2) | — | 74.2 | 48.51 | 58.28 | 43.64 |
| No. of protein atoms | 11741 | 11681 | 11546 | 11436 | 11525 |
| No. of ligand atoms | — | 10 | 114 | 9 | 42 |
| No. of solvent atoms | 167 | 206 | 210 | 500 | 286 |
| Total No. of atoms | 11908 | 11897 | 11870 | 11945 | 11853 |
†
R
cryst = 
. The free R factor was calculated using the 5% of the reflections that were omitted from the refinement).