BMRB Entry 25949
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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/BMR25949
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Title: Ex-4[1-27]/pl14a
Deposition date: 2016-01-12 Original release date: 2016-05-23
Authors: Schroeder, Christina; Swedberg, Joakim; Craik, David
Citation: Swedberg, Joakim; Schroeder, Christina; Mitchell, Justin; Fairlie, David; Price, David; Liras, Spiros; Craik, David. "GLP-1 and exendin-4 alpha-conotoxin pl14a chimeras as potent GLP-1R agonists" Not known ., .-..
Assembly members:
entity, polymer, 39 residues, 4496.178 Da.
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):
entity: HGEGTFTSDLSKQMEEEAVR
CFIECLKGIGHKYPFCHCR
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 242 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | entity | 1 |
Entities:
Entity 1, entity 39 residues - 4496.178 Da.
| 1 | HIS | GLY | GLU | GLY | THR | PHE | THR | SER | ASP | LEU | ||||
| 2 | SER | LYS | GLN | MET | GLU | GLU | GLU | ALA | VAL | ARG | ||||
| 3 | CYS | PHE | ILE | GLU | CYS | LEU | LYS | GLY | ILE | GLY | ||||
| 4 | HIS | LYS | TYR | PRO | PHE | CYS | HIS | CYS | ARG |
Samples:
sample_1: entity 0.2 mM; H2O 90%; D2O 10%
sample_conditions_1: pH: 3.6; 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 |
| 2D 1H-13C HSQC | sample_1 | isotropic | sample_conditions_1 |
Software:
CNS, Brunger, Adams, Clore, Gros, Nilges and Read - refinement
CYANA, Guntert, Mumenthaler and Wuthrich - structure solution
Molmol, Koradi, Billeter and Wuthrich - data analysis
TOPSPIN, Bruker Biospin - collection
XEASY, Bartels et al. - chemical shift assignment, chemical shift calculation, peak picking
NMR spectrometers:
- Bruker Avance 600 MHz