7X8M
NMR Solution Structure of the 2:1 Berberine-KRAS-G4 Complex
Spectrometer
Experimental method: SOLUTION NMR
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Bruker | AVANCE III | 600 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 2D 1H-1H NOESY |
| 2 | 2 | 1 | 2D 1H-1H NOESY |
| 4 | 1 | 1 | 2D DQF-COSY |
| 5 | 1 | 1 | 2D 1H-13C HSQC |
| 6 | 2 | 1 | 2D 1H-15N HSQC |
NMR Sample
| conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
| 1 | 7 | 1 | 298 |
| 2 | 7 | 1 | 308 |
Conformers
| Conformers Calculated Total Number | 100 |
| Conformers Submitted Total Number | 10 |
