1UT3
Solution Structure of Spheniscin-2, a beta-Defensin from Penguin Stomach Preserving Food
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | 2D-1H-COSY | 4.3 | 1 atm | 293 | ||||
| 2 | 2D-1H-TOCSY | 4.3 | 1 atm | 293 | ||||
| 3 | 2D-1H-NOESY | 4.3 | 1 atm | 293 | ||||
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Varian | INOVA | 600 |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | LOWEST ENERGY, LEAST RESTRAINT VIOLATION |
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 10 |
| Representative Model | 1 (n/a) |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | refinement | ARIA1.1/CNS1.1 | LINGE | |
| 2 | structure solution | ARIA/CNS | ||
