SOLUTION NMR

NMR Experiment
Experiment Type Sample Contents Ionic Strength Solvent pH Pressure Temprature (K)
1 15N-EDITED 3D NOESY ? 5.70 ? 298.00
2 13C -EDITED 3D NOESY ? 5.70 ? 298.00
3 2D NOESY ? 5.70 ? 298.00
NMR Spectrometer Information
Spectrometer Manufacturer Model Field Strength
NMR Refinement
Method Details Software
simulated annealing ENERGY INCLUDING L-J POTENTIAL, ELECTROSTATIC POTENTIAL AND EXPERIMENTAL RESTRAINTS WAS MINIMIZED FROM AVERAGE STRUCTURE. 1
NMR Ensemble Information
Conformer Selection Criteria THE AVERAGE STRUCTURE OF 20 STRUCTURES WITH THE LOWEST TARGET FUNCTIONS
Conformers Calculated Total Number 100
Conformers Submitted Total Number 1
Representative Model ()
Computation: NMR Software
# Classification Version Software Name Author
1 refinement 3.1 X-PLOR BRUNGER
2 structure solution 3.1 X-PLOR ?
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