1X9B

Solution NMR Structure of Protein Ta0354 from Thermoplasma acidophilum. Ontario Center for Structural Proteomics target TA0354_69_121; Northeast Structural Genomics Consortium Target TaT38.


SOLUTION NMR
NMR Experiment
ExperimentTypeSample ContentsSolventIonic StrengthpHPressureTemperature (K)Spectrometer
13D_15N-separated_NOESY1 mM ta0354, U-15N,13C; 450 mM NaCl, 25 mM Na2PO4, 1 mM Benzamidine, 1xinhibitor cooktail, 0.01% NaN3, 95% H2O, 5% D2O95% H2O/5% D2O450 mM NaCl, 25 mM Phosphate buffer6.5ambinet298
23D_13C-separated_NOESY1 mM ta0354, U-15N,13C; 450 mM NaCl, 25 mM Na2PO4, 1 mM Benzamidine, 1xinhibitor cooktail, 0.01% NaN3, 95% H2O, 5% D2O95% H2O/5% D2O450 mM NaCl, 25 mM Phosphate buffer6.5ambinet298
34D_13C-separated_NOESY1 mM ta0354, U-15N,13C; 450 mM NaCl, 25 mM Na2PO4, 1 mM Benzamidine, 1xinhibitor cooktail, 0.01% NaN3, 95% H2O, 5% D2O95% H2O/5% D2O450 mM NaCl, 25 mM Phosphate buffer6.5ambinet298
4HNHA1 mM ta0354, U-15N,13C; 450 mM NaCl, 25 mM Na2PO4, 1 mM Benzamidine, 1xinhibitor cooktail, 0.01% NaN3, 95% H2O, 5% D2O95% H2O/5% D2O450 mM NaCl, 25 mM Phosphate buffer6.5ambinet298
NMR Spectrometer Information
SpectrometerManufacturerModelField Strength
1VarianINOVA600
NMR Refinement
MethodDetailsSoftware
simulated annealing1131 NOE-derived distance constraints and 142 torsion angle constraintsNMRPipe
NMR Ensemble Information
Conformer Selection Criteriastructures with the lowest energy
Conformers Calculated Total Number56
Conformers Submitted Total Number10
Representative Model1 (lowest energy)
Computation: NMR Software
#ClassificationVersionSoftware NameAuthor
1processingNMRPipe2.1Delaglio,F.
2structure solutionAutoStructure2.0Huang,Y.J. and Montelione, G.T.
3refinementCNS1.0Brunger, A.T. et al.