BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

Xanthosine (C10H12N4O6)

View large 3D structure

BMRB entry bmse000128

Entry DOI: doi:10.13018/BMSE000128
Data source: Madison Metabolomics Consortium - Qiu Cui, Ian Lewis, Mark E. Anderson, John L. Markley

NMR-STAR file: bmse000128.str
NMR-STAR interactive viewer
Mol file: bmse000128.mol
All files for bmse000128
Time Domain Data: bmse000128.zip

View the GISSMO record for this entry.

Sample and instrument details are given with the spectrum

Assigned chemical shifts

Set 1
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 10.5
Spectrometer: Bruker DMX - 400MHz

Atom IDAuthor NomenclatureValueAmbiguity Code
C9C1190.6611
C6C1275.9741
C5C1373.5581
C3C1488.5321
C1C1564.3561
C7C16155.8554
C7C16118.2074
C2C17140.0611
C4C18155.8554
C4C18118.2074
C8C19163.7474
C8C19162.2764
C10C20163.7474
C10C20162.2764
H27H215.8541
H26H224.7621
H25H234.4011
H24H244.2551
H23H277.8631

NMR experiments

1: 1D 1H
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 10.5
Spectrometer: Bruker DMX - 400MHz

 spectrum for 1
Download time domain data: bmse000128_1.zip

2: 2D [1H,1H]-TOCSY
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 10.5
Spectrometer: Bruker DMX - 400MHz

 spectrum for 2
Download time domain data: bmse000128_2.zip

3: 1D 13C
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 10.5
Spectrometer: Bruker DMX - 400MHz

 spectrum for 3
Download time domain data: bmse000128_3.zip

4: 1D DEPT90
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 10.5
Spectrometer: Bruker DMX - 400MHz

 spectrum for 4
Download time domain data: bmse000128_4.zip

5: 1D DEPT135
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 10.5
Spectrometer: Bruker DMX - 400MHz

 spectrum for 5
Download time domain data: bmse000128_5.zip

6: 2D [1H,13C]-HSQC
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 10.5
Spectrometer: Bruker DMX - 400MHz

 spectrum for 6
Download time domain data: bmse000128_6.zip