Spectrometer
Experimental method: SOLUTION NMR
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Bruker | AVANCE | Bruker Avance | 800 |
| 2 | Bruker | DRX | Bruker DRX | 600 |
| 3 | Bruker | DRX | Bruker DRX | 500 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 11echo and watergate |
| 2 | 2 | 1 | 2D TOCSY |
| 3 | 2 | 1 | 2D NOESY |
| 4 | 1 | 2 | 2D 15N-HMQC, 2D 15N-CPMG-NOESY, 2D JNN-HNN-COSY |
| 5 | 2 | 2 | 2D 13C-HSQCs |
| 6 | 2 | 2 | 2D HCCH COSY, 3D HCCH-TOCSY |
| 7 | 2 | 2 | 3D 1H,13C HMQCs |
NMR Sample
| conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
| 1 | 6.3 | ambient | 298 |
| 2 | 6.3 | ambient | 283 |
Conformers
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 14 |
