Table 2.
Refinement Statistics
| Resolution Range | 40.0-2.1 Å |
| Rcryst | 17.5 % |
| Rcryst (highest resolution shell) | 19.9 % |
| Rfree | 20.7 % |
| Rfree (highest resolution shell) | 24.1 % |
| Wilson B factor (Å3) | 28.7 |
| Average B factora, chain A (Å3), number of atoms | 28.4, 4191 |
| Average B factora, chain B (Å3), number of atoms | 26.7, 4226 |
| Average B factor, solvent (Å3), number of atoms | 36.9, 430 |
| Average B factor, additives (Å3), number of atoms | 44.9, 149 |
| Average B factor, ions (Å3), number of atoms | 40.2, 10 |
| R.m.s. deviations | |
| Bond lengths (Å) | 0.01 |
| Angles (°) | 1.2 |
a
B-factors were calculated prior to the inclusion of TLS refinement as refinement was nearly complete.