1DL6
SOLUTION STRUCTURE OF HUMAN TFIIB N-TERMINAL DOMAIN
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | 3D_15N-SEPARATED_NOESY | 3MM HTFIIB N-TERMINAL DOMAIN U-15N; 50MM PHOSPHATE; 90% H2O, 10% D2O | 7.0 | AMBIENT | 298 | |||
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Varian | INOVA | 600 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| DISTANCE GEOMETRY SIMULATED ANNEALING TORSION ANGLE DYNAMICS | THE STRUCTURES ARE BASED ON A TOTAL OF 443 RESTRAINTS, 431 ARE NOE-DERIVED DISTANCE CONSTRAINTS, 12 DISTANCE RESTRAINTS FROM HYDROGEN BONDS. | VNMR |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | structures with the lowest energy |
| Conformers Calculated Total Number | 29 |
| Conformers Submitted Total Number | 25 |
| Representative Model | 15 (closest to the average) |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | collection | VNMR | 6.1 | VARIAN ASSOCIATES, INC. |
| 2 | processing | NMRPipe | 1.7 | DELAGLIO |
| 3 | data analysis | NMRDraw | 1.7 | DELAGLIO |
| 4 | refinement | CNS | 0.4 | BRUNGER |
