BMRB

Biological Magnetic Resonance Data Bank


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

5-Aminovaleric Acid (C5 H11 N O2)

Natural Isotopic formula weight: 117.14634

View large 3D structure

bmse000957 Data

Entry STAR file: bmse000957.str
NMR-STAR interactive viewer
Time Domain Data: bmse000957.zip
BMRB Entry DOI: doi:10.13018/BMSE000957
Mol file: bmse000957.mol

5-Aminovaleric acid
Source:   Sigma
Solvent:   100 % D2O
Buffer:   200 mM sodium phosphate
Cytocide:   500 µM sodium azide
Reference:   500 µM DSS

Concentration and pH are given with spectrum
Spectrometer: Bruker Avance II - 700 MHz

Data Source: National Institute of Standards and Technology, Hollings Marine Laboratory - Dan Bearden.

View the GISSMO record for this entry.

Atom numbering calculated using ALATIS. Citation: Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773

Experimental Data:

2D J-resolved 1H

Concentration: 20 mM
temperature: 298 K
pH: 7.4
2D J-resolved 1H, 7.4 spectrum for 5-Aminovaleric acid
Download data directory: bmse000957_1.zip

2D [1H,13C]-HSQC

Concentration: 20 mM
temperature: 298 K
pH: 7.4
2D [1H,13C]-HSQC, 7.4 spectrum for 5-Aminovaleric acid
Download data directory: bmse000957_2.zip

1D 1H, NOESY

Concentration: 20 mM
temperature: 298 K
pH: 7.4
1D 1H, NOESY, 7.4 spectrum for 5-Aminovaleric acid
Download data directory: bmse000957_3.zip