BMRB Entry 26874
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR26874
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Title: Roseltide rT1 PubMed: 27991569
Deposition date: 2016-08-10 Original release date: 2017-02-16
Authors: Loo, Shining; Kam, Antony; Xiao, Tianshu; Wang, Wei; Nguyen, Giang K.T.; Liu, Chuan Fa; Tam, James P.
Citation: Loo, Shining; Kam, Antony; Xiao, Tianshu; Wang, Wei; Nguyen, Giang K.T.; Liu, Chuan Fa; Tam, James P.. "Identification and Characterization of Roseltide, a Knottin-type Neutrophil Elastase Inhibitor Derived from Hibiscus sabdariffa" Sci. Rep. 6, 39401-39401 (2016).
Assembly members:
roseltides_rT1, polymer, 27 residues, Formula weight is not available
Natural source: Common Name: Hibiscus sabdariffa Taxonomy ID: 183260 Superkingdom: Eukaryota Kingdom: Viridiplantae Genus/species: Hibiscus sabdariffa
Experimental source: Production method: purified from the natural source
Entity Sequences (FASTA):
roseltides_rT1: CIPRGGICLVALSGCCNSPG
CIFGICA
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 160 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | roseltides rT1 | 1 |
Entities:
Entity 1, roseltides rT1 27 residues - Formula weight is not available
| 1 | CYS | ILE | PRO | ARG | GLY | GLY | ILE | CYS | LEU | VAL | ||||
| 2 | ALA | LEU | SER | GLY | CYS | CYS | ASN | SER | PRO | GLY | ||||
| 3 | CYS | ILE | PHE | GLY | ILE | CYS | ALA |
Samples:
sample_1: D2O, [U-100% 2H], 1000 mM; H2O 55600 mM; TFA 1.3 mM; NaCl 0.3 mM
sample_conditions_1: pH: 3.5; pressure: 1 atm; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-1H TOCSY | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-1H NOESY | sample_1 | isotropic | sample_conditions_1 |
Software:
SPARKY v3.115, Goddard - chemical shift assignment
NMR spectrometers:
- Bruker Avance 600 MHz