2MCE
Membrane induced structure of the mammalian tachykinin neuropeptide gamma
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | 2D 1H-1H TOCSY | 4 mg entity-1, 250 mM [U-100% 2H] DPC-2 | 90% H2O/10% D2O | 2.4 | ambient | 305 | ||
| 2 | 2D 1H-1H NOESY | 4 mg entity-1, 250 mM [U-100% 2H] DPC-2 | 90% H2O/10% D2O | 2.4 | ambient | 305 | ||
| 3 | 2D DQF-COSY | 4 mg entity-1, 250 mM [U-100% 2H] DPC-2 | 90% H2O/10% D2O | 2.4 | ambient | 305 | ||
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | DRX | 500 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| torsion angle dynamics | TopSpin | |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | target function |
| Conformers Calculated Total Number | 50 |
| Conformers Submitted Total Number | 20 |
| Representative Model | 1 (closest to the average) |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | data analysis | TopSpin | Bruker Biospin | |
| 2 | processing | TopSpin | Bruker Biospin | |
| 3 | structure solution | DIANA | Guntert, Braun and Wuthrich | |
| 4 | refinement | DIANA | Guntert, Braun and Wuthrich | |
