SOLUTION NMR
NMR Spectrometer Information
SpectrometerManufacturerModelField Strength
1BrukerAMX800
2BrukerAMX600
NMR Refinement
MethodDetailsSoftware
simulated annealingAzara
NMR Ensemble Information
Conformer Selection Criteriastructures with favorable non-bond energy
Conformers Calculated Total Number110
Conformers Submitted Total Number24
Computation: NMR Software
#ClassificationVersionSoftware NameAuthor
1processingAzara
2data analysisANSIG
3structure solutionCNS
4refinementCNS