L-Arginine L-Glutamate (C11H23N5O6)
BMRB entry bmse000194
Entry DOI: doi:10.13018/BMSE000194
Data source: Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Gareth Westler, Mark E. Anderson, John L. Markley
NMR-STAR file:
bmse000194.strNMR-STAR
interactive viewerStructure file (mol/sdf):
bmse000194.molAll files for
bmse000194Time Domain Data:
bmse000194.zipSample and instrument details are given with the spectrum
Assigned chemical shifts
Set 1
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C1 | C1 | 26.565 | 1 |
| C2 | C2 | 30.281 | 1 |
| C3 | C3 | 43.186 | 1 |
| C4 | C4 | 56.988 | 1 |
| C27 | C13 | 29.682 | 1 |
| C29 | C14 | 57.326 | 1 |
| C28 | C15 | 36.177 | 1 |
| H13 | H23 | 1.684 | 1 |
| H14 | H24 | 1.684 | 1 |
| H15 | H25 | 1.905 | 1 |
| H16 | H26 | 1.905 | 1 |
| H17 | H27 | 3.233 | 1 |
| H18 | H28 | 3.233 | 1 |
| H19 | H29 | 3.763 | 1 |
| H37 | H37 | 2.079 | 1 |
| H38 | H38 | 2.079 | 1 |
| H41 | H39 | 3.75 | 1 |
| H39 | H40 | 2.34 | 1 |
| H40 | H41 | 2.34 | 1 |
NMR experiments
1: 1D 1H
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
2: 2D [1H,1H]-TOCSY
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
![Spectrum for experiment #2: 2D [1H,1H]-TOCSY](/ftp/pub/bmrb/metabolomics/entry_directories/bmse000194/nmr/set01/spectra/HH_TOCSY.png)
3: 1D 13C
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
4: 1D DEPT90
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
5: 1D DEPT135
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
6: 2D [1H,13C]-HSQC
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 400MHz
![Spectrum for experiment #6: 2D [1H,13C]-HSQC](/ftp/pub/bmrb/metabolomics/entry_directories/bmse000194/nmr/set01/spectra/1H_13C_HSQC.png)