BMRB Entry 18289
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Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR18289
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Title: Solution structure of de novo designed peptide 4m
Deposition date: 2012-02-22 Original release date: 2012-10-22
Authors: Bhunia, Anirban
Citation: Bhunia, Anirban. "Solution structure of de novo designed antifreeze peptide 4m" Not known ., .-..
Assembly members:
entity, polymer, 30 residues, 3072.546 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: VKGRIDAPDFPSSPAILGKA
ATDVVAAWKS
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 81 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | antifreeze_peptide_4m | 1 |
Entities:
Entity 1, antifreeze_peptide_4m 30 residues - 3072.546 Da.
| 1 | VAL | LYS | GLY | ARG | ILE | ASP | ALA | PRO | ASP | PHE | |
| 2 | PRO | SER | SER | PRO | ALA | ILE | LEU | GLY | LYS | ALA | |
| 3 | ALA | THR | ASP | VAL | VAL | ALA | ALA | TRP | LYS | SER |
Samples:
sample_1: antifreeze_peptide_4m 0.8 mM; H2O 90%; D2O 10%
sample_conditions_1: pH: 5.0; temperature: 288 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:
DYANA v1.5, Guntert, Braun and Wuthrich - refinement
NMR spectrometers:
- Bruker Avance 800 MHz
- Bruker Avance 500 MHz
Related Database Links:
| PDB |