BMRB Entry 19901
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR19901
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Title: 1H, 13C, and 15N Chemical Shift Assignments for Thymosin alpha 1 PubMed: 25642593
Deposition date: 2014-04-09 Original release date: 2015-03-02
Authors: Nepravishta, Ridvan; Mandaliti, Walter; Eliseo, Tommaso; Sinibaldi Vallebona, Paola; Garaci, Enrico; Paci, Maurizio
Citation: Nepravishta, Ridvan; Mandaliti, Walter; Eliseo, Tommaso; Sinibaldi Vallebona, Paola; Garaci, Enrico; Paci, Maurizio. "Thymosin alpha 1 inserts N terminus into model membranes assuming a helical conformation" Expert Opin. Biol. Ther. 15, S71-S81 (2015).
Assembly members:
Thymosin_alpha_1_polypeptide, polymer, 29 residues, 3070.300 Da.
Natural source: Common Name: human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
Thymosin_alpha_1_polypeptide: XSDAAVDTSSEITTKDLKEK
KEVVEEAEN
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 81 |
| 15N chemical shifts | 29 |
| 1H chemical shifts | 171 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | Thymosin_alpha_1_polypeptide | 1 |
Entities:
Entity 1, Thymosin_alpha_1_polypeptide 29 residues - 3070.300 Da.
| 1 | ACE | SER | ASP | ALA | ALA | VAL | ASP | THR | SER | SER | ||||
| 2 | GLU | ILE | THR | THR | LYS | ASP | LEU | LYS | GLU | LYS | ||||
| 3 | LYS | GLU | VAL | VAL | GLU | GLU | ALA | GLU | ASN |
Samples:
sample_1: Thymosin alpha 1 polypeptide 8 mM; SDS, [U-100% 2H], 80 mM; H2O 90%; D2O 10%
sample_conditions_1: pH: 6.5; pressure: 1 atm; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-1H TOCSY | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-1H NOESY | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-13C HSQC | sample_1 | isotropic | sample_conditions_1 |
Software:
NMRView v9.0.0-b110, Johnson, One Moon Scientific - chemical shift assignment
NMR spectrometers:
- Bruker Avance 700 MHz
Download simulated HSQC data in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts