SOLUTION NMR

NMR Experiment
Experiment Type Sample Contents Ionic Strength Solvent pH Pressure Temprature (K)
1 2D/3D NOESY 10% H2O/90% D2O, 100% D2O 20 mM 6.8 1 298
2 COSY 10% H2O/90% D2O, 100% D2O 20 mM 6.8 1 298
3 HETCOR 10% H2O/90% D2O, 100% D2O 20 mM 6.8 1 298
NMR Spectrometer Information
Spectrometer Manufacturer Model Field Strength
1 Bruker AMX500 500
NMR Refinement
Method Details Software
simulated annealing REFINEMENT DETAILS CAN BE FOUND IN THE JRNL CITATION ABOVE. 1
NMR Ensemble Information
Conformer Selection Criteria LEAST RESTRAINT VIOLATION
Conformers Calculated Total Number 75
Conformers Submitted Total Number 12
Representative Model ()
Computation: NMR Software
# Classification Version Software Name Author
1 refinement 3.1 X-PLOR BRUNGER
2 structure solution 950 Felix ?
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