2K71
Structure and dynamics of a DNA GNRA hairpin solved vy high-sensitivity NMR with two independent converging methods, simulated annealing (DYANA) and mesoscopic molecular modelling (BCE/AMBER)
Spectrometer
Experimental method: SOLUTION NMR
Spectrometer ID | Spectrometer maker | Spectrometer model | Spectrometer type | Spectrometer field strength |
1 | Varian | INOVA | Varian INOVA | 750 |
2 | Varian | UNITY | Varian Unity | 400 |
Experiment
experiment id | conditions id | solution id | Experiment type |
1 | 1 | 1 | 2D DQF-COSY |
2 | 1 | 1 | 2D 1H-13C HSQC |
3 | 1 | 1 | 2D 1H-31P COSY |
4 | 1 | 1 | 2D 1H-1H NOESY |
5 | 2 | 2 | 2D 1H-1H NOESY |
NMR Sample
conditions id | NMR sample pH | NMR sample pressure | NMR sample temperature |
1 | 6.8 | ambient | 298 |
2 | 6.8 | ambient | 274 |
Conformers
Conformers Calculated Total Number | 101 |
Conformers Submitted Total Number | 21 |