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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Creatinine - Supplemental Proton Data (C4 H7 N3 O)

Natural Isotopic formula weight: 113.1178800000

View large 3D structure

bmse000789 Data

Entry STAR file: bmse000789.str
NMR-STAR interactive viewer
Mol file: bmse000789.mol
All files for bmse000789
Time Domain Data: bmse000789.zip
BMRB Entry DOI: doi:10.13018/BMSE000789

Creatinine
Source:   sigma/aldrich
Solvent:   100 % D2O
Buffer:   50 mM sodium phosphate
Cytocide:   500 µM sodium azide
Reference:   2.5 µM DSS

Concentration and pH are given with spectrum
Spectrometer: Bruker DMX - 500 MHz

Data Source: Madison Metabolomics Consortium - Francisca Jofre, Sergio Davila, Mark E. Anderson, John L. Markley.

Experimental Data:

1D 1H, 0.5 mM, pH 6.836

Concentration: 0.5 mM
temperature: 298 K
pH: 6.836
1D 1H, 0.5 mM, pH 6.836, 6.836 spectrum for Creatinine - supplemental proton data
Download time domain data: bmse000789_1.zip

1D 1H, 0.5 mM, pH 2

Concentration: 0.5 mM
temperature: 298 K
pH: 1.989
1D 1H, 0.5 mM, pH 2, 1.989 spectrum for Creatinine - supplemental proton data
Download time domain data: bmse000789_2.zip

1D 1H, 0.5 mM, pH 5

Concentration: 0.5 mM
temperature: 298 K
pH: 4.986
1D 1H, 0.5 mM, pH 5, 4.986 spectrum for Creatinine - supplemental proton data
Download time domain data: bmse000789_3.zip

1D 1H, 0.5 mM, pH 7

Concentration: 0.5 mM
temperature: 298 K
pH: 7.395
1D 1H, 0.5 mM, pH 7, 7.395 spectrum for Creatinine - supplemental proton data
Download time domain data: bmse000789_4.zip

1D 1H, 100 mM, pH 6.836

Concentration: 100 mM
temperature: 298 K
pH: 6.836
1D 1H, 100 mM, pH 6.836, 6.836 spectrum for Creatinine - supplemental proton data
Download time domain data: bmse000789_5.zip

1D 1H, 100 mM, pH 2

Concentration: 100 mM
temperature: 298 K
pH: 1.989
1D 1H, 100 mM, pH 2, 1.989 spectrum for Creatinine - supplemental proton data
Download time domain data: bmse000789_6.zip

1D 1H, 100 mM, pH 5

Concentration: 100 mM
temperature: 298 K
pH: 4.986
1D 1H, 100 mM, pH 5, 4.986 spectrum for Creatinine - supplemental proton data
Download time domain data: bmse000789_7.zip

1D 1H, 100 mM, pH 9

Concentration: 100 mM
temperature: 298 K
pH: 8.962
1D 1H, 100 mM, pH 9, 8.962 spectrum for Creatinine - supplemental proton data
Download time domain data: bmse000789_8.zip