Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR25295
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Citation: Platzer, Gerald; Okon, Mark; McIntosh, Lawrence. "pH-dependent random coil 1H, 13C, and 15N chemical shifts of the ionizable amino acids: a guide for protein pKa measurements" J. Biomol. NMR 60, 109-129 (2014).
PubMed: 25239571
Assembly members:
alanine amide, non-polymer, Formula weight is not available
Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: not available Kingdom: not available Genus/species: not available not available
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
alanine amide: AX
Data type | Count |
pKa values | 6 |
pH NMR parameter values | 66 |
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | alanine amide | 1 |
Entity 1, alanine amide 2 residues - Formula weight is not available
1 | ALA | NH2 |
sample_1: alanine amide, [U-13C; U-15N], 10 mM; NaCl 50 mM
sample_conditions_1: temperature: 298 K; pH: 7; pressure: 1 atm; ionic strength: 50 mM
Name | Sample | Sample state | Sample conditions |
---|---|---|---|
1D 1H-NMR | sample_1 | isotropic | sample_conditions_1 |
2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
2D 1H-13C HSQC | sample_1 | isotropic | sample_conditions_1 |
multiple-bond 13C HMBC | sample_1 | isotropic | sample_conditions_1 |
multiple-bond 15N HMBC | sample_1 | isotropic | sample_conditions_1 |
TOPSPIN v3, Bruker Biospin - chemical shift assignment, data analysis