NMR restraints and statistics
| NMR constraints . | Values . |
|---|---|
| Distance constraints | 1851 |
| Intraresidual | 911 |
| Sequential | 483 |
| Medium-range | 196 |
| Long-range | 215 |
| Ambiguously assigned | 46 |
| Dihedral angle constraints* | |
| φ | 79 |
| ψ | 79 |
| JHNHα coupling constants | 20 |
| Residual dipolar couplings | |
| JHN | 66 |
| JNC′ | 50 |
| JC′Cα | 54 |
| RMS deviations for constraints | |
| Distance constraints, Å | 0.016 ± 0.002 |
| Dihedral angles, degrees | 0.33 ± 0.06 |
| JHNHα coupling constants (Hz) | 0.78 ± 0.05 |
| RDCs (Hz) | |
| JHN | 1.69 ± 0.09 |
| JNC′ | 0.34 ± 0.01 |
| JC′Cα | 0.95 ± 0.06 |
| RMS deviations from covalent geometry | |
| Bond lengths, Å | 0.003 ± 0.0002 |
| Bond angles, degrees | 0.45 ± 0.014 |
| Impropers, degree | 0.31 ± 0.017 |
| Ramachandran plot statistics (%)† | eTAFH (267-353), HEB (14-26) |
| Residues in most favored regions | 85.0 |
| Residues in additionally allowed regions | 12.0 |
| Residues in generously allowed regions | 2.1 |
| Residues in disallowed regions | 1.3 |
| RMS deviations from average structure, Å | eTAFH (270-345), HEB (16-21) |
| Backbone atoms | 0.77 ± 0.13 |
| Heavy atoms | 1.59 ± 0.16 |
| NMR constraints . | Values . |
|---|---|
| Distance constraints | 1851 |
| Intraresidual | 911 |
| Sequential | 483 |
| Medium-range | 196 |
| Long-range | 215 |
| Ambiguously assigned | 46 |
| Dihedral angle constraints* | |
| φ | 79 |
| ψ | 79 |
| JHNHα coupling constants | 20 |
| Residual dipolar couplings | |
| JHN | 66 |
| JNC′ | 50 |
| JC′Cα | 54 |
| RMS deviations for constraints | |
| Distance constraints, Å | 0.016 ± 0.002 |
| Dihedral angles, degrees | 0.33 ± 0.06 |
| JHNHα coupling constants (Hz) | 0.78 ± 0.05 |
| RDCs (Hz) | |
| JHN | 1.69 ± 0.09 |
| JNC′ | 0.34 ± 0.01 |
| JC′Cα | 0.95 ± 0.06 |
| RMS deviations from covalent geometry | |
| Bond lengths, Å | 0.003 ± 0.0002 |
| Bond angles, degrees | 0.45 ± 0.014 |
| Impropers, degree | 0.31 ± 0.017 |
| Ramachandran plot statistics (%)† | eTAFH (267-353), HEB (14-26) |
| Residues in most favored regions | 85.0 |
| Residues in additionally allowed regions | 12.0 |
| Residues in generously allowed regions | 2.1 |
| Residues in disallowed regions | 1.3 |
| RMS deviations from average structure, Å | eTAFH (270-345), HEB (16-21) |
| Backbone atoms | 0.77 ± 0.13 |
| Heavy atoms | 1.59 ± 0.16 |