2KNP
Isolation and characterization of peptides from Momordica cochinchinensis seeds.
SOLUTION NMR
| NMR Experiment | ||||||||
|---|---|---|---|---|---|---|---|---|
| Experiment | Type | Sample Contents | Solvent | Ionic Strength | pH | Pressure | Temperature (K) | Spectrometer |
| 1 | 2D DQF-COSY | 2mg/mL MCoCC-1-1 | 90% H2O/10% D2O | 5.5 | ambient | 298 | ||
| 2 | 2D 1H-1H NOESY | 2mg/mL MCoCC-1-1 | 90% H2O/10% D2O | 5.5 | ambient | 298 | ||
| 3 | 2D 1H-1H TOCSY | 2mg/mL MCoCC-1-1 | 90% H2O/10% D2O | 5.5 | ambient | 298 | ||
| NMR Spectrometer Information | |||
|---|---|---|---|
| Spectrometer | Manufacturer | Model | Field Strength |
| 1 | Bruker | AVANCE | 500 |
| 2 | Bruker | AVANCE | 600 |
| NMR Refinement | ||
|---|---|---|
| Method | Details | Software |
| simulated annealing | CNS | |
| NMR Ensemble Information | |
|---|---|
| Conformer Selection Criteria | structures with the lowest energy |
| Conformers Calculated Total Number | 50 |
| Conformers Submitted Total Number | 20 |
| Representative Model | 1 (lowest energy) |
| Computation: NMR Software | ||||
|---|---|---|---|---|
| # | Classification | Version | Software Name | Author |
| 1 | chemical shift calculation | CNS | 1.1 | |
| 2 | chemical shift assignment | CNS | 1.1 | |
| 3 | data analysis | CNS | 1.1 | |
| 4 | refinement | CNS | 1.1 | |
| 5 | processing | CNS | 1.1 | |
