SOLUTION NMR

NMR Experiment
Experiment Type Sample Contents Ionic Strength Solvent pH Pressure Temprature (K)
1 NOESY H2O AND D2O 0.5 M 7.0 1 298
2 COSY H2O AND D2O 0.5 M 7.0 1 298
NMR Spectrometer Information
Spectrometer Manufacturer Model Field Strength
1 Bruker AMX600 600
NMR Refinement
Method Details Software
MOLECULAR DYNAMIC (RMD) AND MONTE CARLO (RMC) CALCULATIONS REFINEMENT DETAILS CAN BE FOUND IN THE BIOCHEMISTRY CITATION ABOVE. MODEL 1 : REFINED BY RMD FROM A-DNA MODEL 2 : REFINED BY RMD FROM B-DNA MODEL 3 : REFINED BY RMC FROM A-DNA MODEL 4 : REFINED BY RMC FROM B-DNA 1
NMR Ensemble Information
Conformer Selection Criteria CONVERGENCE, R FACTORS, ENERGIES
Conformers Calculated Total Number 20
Conformers Submitted Total Number 4
Representative Model ()
Computation: NMR Software
# Classification Version Software Name Author
1 refinement ? MARDIGRAS PEARLMAN
2 structure solution ? MARDIGRAS ?
3 structure solution ? Amber ?
4 structure solution ? DNAminiCarlo ?
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