Table I.
Structural Statistics and Restraint Information for the NMR Structure of the PAI Subdomain
| Restraints and statistics | |
|---|---|
| Restraints | |
| NOE distance restraints (total) | 418 |
| Average number of NOE restraints per residue | 7.4 |
| Medium and long-range NOEs (j − i >3) | 130 |
| Hydrogen bonds | 26 |
| Residual dipolar couplings (Hz) | 28 |
| TALOS derived dihedral angle restraints | 51 |
| Violations | |
| NOE distance violations >0.5 Å | 0 |
| Dihedral angle violations >5° | 0 |
| RMS deviation from mean structure (Å) | |
| All heavy atoms | 1.4 |
| Backbone atoms | 0.7 |
| Ramachandran statisticsa (%) | |
| Most favored region | 96.7 |
| Additionally allowed region | 2.8 |
| Generously allowed region | 0.5 |
| Disallowed region | 0 |
a
Values were calculated for the ordered residues of the protein.