2K7W
BAX Activation is Initiated at a Novel Interaction Site
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | 2D 1H-15N HSQC | 0.1-0.2 mM [U-99% 15N] protein, 0.1-0.2 mM peptide | 90% H2O/10%D20 | 50 | 6.0 | ambient | 305 | |
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | DRX | 800 |
| 2 | Bruker | DRX | 600 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| simulated annealing | STRUCTURES CALCULATED WITH HADDOCK 2.0 | NMRView |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | structures with the lowest energy |
| Conformers Calculated Total Number | 1500 |
| Conformers Submitted Total Number | 20 |
| Representative Model | 1 (n/a) |
| Additional NMR Experimental Information | |
|---|---|
| Details | BAX-BIM SAHB INTERACTION ANALYSIS, PARAMAGNETIC SPIN-LABELING NMR |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | data analysis | NMRView | Johnson, B. et al. | |
| 2 | refinement | CNS | Brunger, A. et al. | |
| 3 | processing | NMRPipe | Delaglio, F. et al. | |
