SOLUTION NMR


NMR Experiment
Experiment Type Sample Contents Ionic Strength Solvent pH Pressure Temprature (K)
1 3D_13C-separated_NOESY 0.5mM of 13C/15N-labeled YflL in 90% H2O/10% 2H2O buffer containing 50mM Tris HAc of pH 7.0, 0.01% sodium azide 50mM Tris-HAc 90% H2O/10% D2O 7.0 1 298
2 3D_15N-separated_NOESY 0.5mM of 13C/15N-labeled YflL in 90% H2O/10% 2H2O buffer containing 50mM Tris HAc of pH 7.0, 0.01% sodium azide 50mM Tris-HAc 90% H2O/10% D2O 7.0 1 298
3 HNHA 0.5mM of 13C/15N-labeled YflL in 90% H2O/10% 2H2O buffer containing 50mM Tris HAc of pH 7.0, 0.01% sodium azide 50mM Tris-HAc 90% H2O/10% D2O 7.0 1 298
NMR Spectrometer Information
Spectrometer Manufacturer Model Field Strength
NMR Refinement
Method Details Software
molecular dynamics ? 1
NMR Ensemble Information
Conformer Selection Criteria structures with the least restraint violations
Conformers Calculated Total Number 200
Conformers Submitted Total Number 20
Representative Model 1 (fewest violations)
Computation: NMR Software
# Classification Version Software Name Author
1 collection 3.5 XwinNMR ?
2 processing ? NMRPipe ?
3 structure solution ? CYANA ?
4 refinement ? Amber ?
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