1ZTS

Solution Structure of Bacillus Subtilis Protein YQBG: Northeast Structural Genomics Consortium Target SR215


SOLUTION NMR
NMR Experiment
ExperimentTypeSample ContentsSolventIonic StrengthpHPressureTemperature (K)Spectrometer
1SIMULTANEOUS HETERONUCLEAR RESOLVED [1H,1H] NOESY0.94 MM, U-15N,13C; NMR BUFFER 6.5, 5% D2O, 0.02% NAN3, 10MM DTT, 5MM CACL2, 100MM NACL, 20MM MES,PH 6.5; 95% H2O, 5% D2O95% H2O/5% D2O6.5AMBIENT298
2GFT (4,3)D HNNCABCB0.94 MM, U-15N,13C; NMR BUFFER 6.5, 5% D2O, 0.02% NAN3, 10MM DTT, 5MM CACL2, 100MM NACL, 20MM MES,PH 6.5; 95% H2O, 5% D2O95% H2O/5% D2O6.5AMBIENT298
3GFT (4,3)D CABCB(CO)NHN0.94 MM, U-15N,13C; NMR BUFFER 6.5, 5% D2O, 0.02% NAN3, 10MM DTT, 5MM CACL2, 100MM NACL, 20MM MES,PH 6.5; 95% H2O, 5% D2O95% H2O/5% D2O6.5AMBIENT298
4GFT (4,3)D HABCAB(CO)NHN0.94 MM, U-15N,13C; NMR BUFFER 6.5, 5% D2O, 0.02% NAN3, 10MM DTT, 5MM CACL2, 100MM NACL, 20MM MES,PH 6.5; 95% H2O, 5% D2O95% H2O/5% D2O6.5AMBIENT298
5GFT (4,3)D HCCH0.94 MM, U-15N,13C; NMR BUFFER 6.5, 5% D2O, 0.02% NAN3, 10MM DTT, 5MM CACL2, 100MM NACL, 20MM MES,PH 6.5; 95% H2O, 5% D2O95% H2O/5% D2O6.5AMBIENT298
NMR Spectrometer Information
SpectrometerManufacturerModelField Strength
1VarianINOVA750
2VarianINOVA600
NMR Refinement
MethodDetailsSoftware
TORSION ANGLE DYNAMICS distance geometryCYANA
NMR Ensemble Information
Conformer Selection Criteriatarget function
Conformers Calculated Total Number100
Conformers Submitted Total Number20
Representative Model1 (fewest violations)
Additional NMR Experimental Information
Detailsby using CYANA2.0
Computation: NMR Software
#ClassificationVersionSoftware NameAuthor
1refinementCYANA2.0P.GUNTERT ET AL.
2structure solutionCYANA2.0P.GUNTERT ET AL.
3data analysisXEASY1.3.1.3C. Bartels ET AL.
4processingNMRPipe2.3G. Cornilescu ET AL
5data analysisAutoStructure2.0.0Y J HUANG ET AL
6data analysisCYANA1.0.5P.GUNTERT ET AL.