Table 1. Structural and NMR statistics of TF dimer.
| Distance restraints* | |
|---|---|
| NOEs | |
| Short range (intraresidue and sequential) | 870 |
| Medium range (2 < | i-j | < 5) | 467 |
| Long range ( | i-j | > 5 ) | 1230 |
| Intermolecular | 54 |
| Hydrogen bonds | 374 |
| Dihedral angle restraints (cp and | 1358 |
| Violations (mean and SD)* | |
| Distance restraints (A) | 0.005 ± 0.025 |
| Dihedral angle restraints (°) | 0.02 ± |
| 0.23 | |
| Structural coordinates rmsd* | |
| RBD core (1-39, 51-112) | |
| Chain A | |
| Backbone atoms | 1.50 ± 0. A |
| All heavy atoms | 2.04 ± 0.29 A |
| Chain B | |
| Backbone atoms | 1.56 ± 0.41 A |
| All heavy atoms | 2.07 ± 0.38 A |
| PPD core (157-190,195-241) | |
| Chain A | |
| Backbone atoms | 0.87 ± 0.09 A |
| All heavy atoms | 1.38 ± 0.07 A |
| Chain B | |
| Backbone atoms | 0.82 ± 0.14 A |
| All heavy atoms | 1.30 ± 0.11 A |
| SBD core (115-149, 250-321, 329-428) | |
| Chain A | |
| Backbone atoms | 1.40 ± 0.21A |
| All heavy atoms | 2.17 ± 0.23 A |
| Chain B | |
| Backbone atoms | 1.34 ± 0.16A |
| All heavy atoms | 2.14 ± 0.20 A |
| Ramachandran plot* | |
| Most-favored regions | 85.4% |
| Additionally allowed regions | 14.3% |
| Generously allowed regions | 0.3% |
| Disallowed regions | 0.0% |
*The statistics apply to the 20 lowest-energy structures.