Table 1.
Structural statistics for free-state Sox231–127
| A. Restraint information | |
|---|---|
| Total number of distance restraints | 1577 |
| Intra-residual/sequential/medium/long | 454/423/455/245 |
| Total number of RDC restraints | 43 |
| 97/42/16/0 | |
| Total number of backbone dihedral angle restraints f/yq | 57/60 |
| B. Average deviation from experimental restraints | |
| RMS experimental distance restraints (Å) | 0.0090 ± 0.0010 |
| Average number of distance violations > 0.5 Å | 0 |
| RMS experimental dihedral angle restraints (°) | 0.249 ± 0.055 |
| Average number of dihedral angle violations > 5° | 0 |
| RMS experimental RDC restraints (Hz) | 0.79 ± 0.02 |
| RDC Q-factor | 8.07 ± 0.21 |
| C. Coordinate RMS deviation (Å) | |
| Average overall RMSD to mean structure a | |
| Ordered heavy backbone atoms | 0.46 ± 0.19 |
| Ordered all heavy atoms | 0.86 ± 0.13 |
| Global backbone atoms | 9.58 ± 3.81 |
| 1.64 | |
| Global all heavy atoms | 9.84 ± 3.71 |
| 2.25 | |
| D. Ramachandran plot quality parameters (%) a | |
| Residues in most favored regions (ordered/global) | 97.8 / 77.0 |
| 83.0 /± 4.5 | |
| Residues in allowed regions (ordered/global) | 2.2 / 19.0 |
| 13.5 ± 4.0 | |
| Residues in additionally allowed regions (ordered/global) | 0.0 / 2.6 |
| 2.3 ± 2.1 | |
| Residues in disallowed regions (ordered/global) | 0.0 / 1.4 |
| 1.1 ± 1.1 | |
| E. Abnormalities found in structural checks | |
| Abnormally short interatomic distances /1000 atoms | 4.24 |
| 10 ± 2 | |
Statistics are given for residues 31–127. Ordered regions are residues 45–103.