Mass: 451.490 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C21H25NO8S
-
Experimental details
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Experiment
Experiment
Method: SOLUTION NMR
NMR experiment
Conditions-ID
Experiment-ID
Solution-ID
Sample state
Spectrometer-ID
Type
1
1
1
isotropic
2
2D 1H-15N HSQC
1
2
1
isotropic
2
2D 1H-13C HSQC aliphatic
1
3
1
isotropic
2
2D 1H-13C HSQC aromatic
1
4
1
isotropic
1
3D 1H-15N NOESY
1
5
1
isotropic
2
3D 1H-13C NOESY aliphatic
1
6
1
isotropic
2
3D 1H-13C NOESY aromatic
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Sample preparation
Details
Type: solution Contents: 200 uM [U-99% 13C; U-99% 15N] B-RAF RBD:Rigosertib Complex II, 90% H2O/10% D2O Details: 200 uM B-RAF RBD complexed with 1000uM of Rigosertib in 20 mM KH2PO4, 200 mM NaCl, pH 7.4. Label: C13/N15 sample / Solvent system: 90% H2O/10% D2O
Sample
Conc.: 200 uM / Component: B-RAF RBD:Rigosertib Complex II / Isotopic labeling: [U-99% 13C; U-99% 15N]
Sample conditions
Details: 200 uM B-RAF RBD complexed with 1000uM of Rigosertib in 20 mM KH2PO4, 200 mM NaCl, pH 7.4. Ionic strength: 200 mM / Label: Condition_1 / pH: 7.4 / Pressure: 1 atm / Temperature: 298 K
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