BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
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L-Tyrosine (C9H11NO3)

View large 3D structure

BMRB entry bmse000051

Entry DOI: doi:10.13018/BMSE000051
Data source: Madison Metabolomics Consortium - Francisca Jofre, Mark E. Anderson, John L. Markley, Melanie E. Ulrich

NMR-STAR file: bmse000051.str
NMR-STAR interactive viewer
Mol file: bmse000051.mol
All files for bmse000051
Time Domain Data: bmse000051.zip

View the GISSMO record for this entry.

Sample and instrument details are given with the spectrum

Assigned chemical shifts

Set 1
Sample: multiple; see NMR-STAR file
Conditions: multiple; see NMR-STAR file
Spectrometer: multiple; see NMR-STAR file

Atom IDAuthor NomenclatureValueAmbiguity Code
C1C1133.5312
C2C2133.5312
C3C3118.6102
C4C4118.6102
C5C538.2771
C6C6129.5231
C7C7157.6831
C8C858.8381
C9C9176.9641
H14H147.1922
H15H157.1922
H16H166.8982
H17H176.8982
H18H183.2001
H18H183.0551
H19H193.2001
H19H193.0551
H20H203.9361

NMR experiments

1: 1D 1H, 0.5 mM
Sample: 0.5mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.70
Spectrometer: Bruker DMX - 500MHz

 spectrum for 1
Download time domain data: bmse000051_1.zip

2: 1D 1H, 2.0 mM
Sample: 2.0mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 9.43
Spectrometer: Bruker DMX - 500MHz

 spectrum for 2
Download time domain data: bmse000051_2.zip

3: 1D 1H
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 11.15
Spectrometer: Bruker DMX - 500MHz

 spectrum for 3
Download time domain data: bmse000051_3.zip

4: 2D [1H,1H]-TOCSY
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 11.15
Spectrometer: Bruker DMX - 500MHz

 spectrum for 4
Download time domain data: bmse000051_4.zip

5: 1D 13C
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 11.15
Spectrometer: Bruker DMX - 500MHz

 spectrum for 5
Download time domain data: bmse000051_5.zip

6: 1D DEPT90
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 11.15
Spectrometer: Bruker DMX - 500MHz

 spectrum for 6
Download time domain data: bmse000051_6.zip

7: 1D DEPT135
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 11.15
Spectrometer: Bruker DMX - 500MHz

 spectrum for 7
Download time domain data: bmse000051_7.zip

8: 2D [1H,13C]-HSQC
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 11.15
Spectrometer: Bruker DMX - 500MHz

 spectrum for 8
Download time domain data: bmse000051_8.zip

9: 2D [1H,13C]-HMBC
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 11.15
Spectrometer: Bruker DMX - 500MHz

 spectrum for 9
Download time domain data: bmse000051_9.zip

10: 2D [1H,1H]-COSY
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 11.15
Spectrometer: Bruker DMX - 500MHz

 spectrum for 10
Download time domain data: bmse000051_10.zip

11: 2D [1H,13C]-HSQC SW small
Sample: saturatedmM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 10.5
Spectrometer: Bruker DMX - 400MHz

 spectrum for 11
Download time domain data: bmse000051_11.zip