7RNO
Model of the Ac-6-FP/hpMR1/bB2m/TAPBPR complex from integrated docking, NMR and restrained MD
Spectrometer
Experimental method: SOLUTION NMR
| Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
| 1 | Bruker | AVANCE III | 600 | |
| 2 | Bruker | AVANCE III | 800 |
Experiment
| experiment id | conditions id | solution id | Experiment type |
| 1 | 1 | 1 | 2D 1H-13C HMQC |
| 2 | 1 | 1 | 2D 1H-13C HMQC |
| 3 | 1 | 1 | 3D NOESY HMQC |
NMR Sample
| conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
| 1 | 7.2 | 1.01325 | 298.15 |
Conformers
| Conformers Calculated Total Number | 10000 |
| Conformers Submitted Total Number | 10 |
