BMRB Entry 6425
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR6425
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Title: NMR strcutre of sst1-selective somatostatin (SRIF) analog 1 PubMed: 15658866
Deposition date: 2004-12-10 Original release date: 2008-07-16
Authors: Grace, C.; Durrer, D.; Koerber, S.; Erchegyi, J.; Reubi, J.; Rivier, J.; Riek, R.
Citation: Grace, C.; Durrer, D.; Koerber, S.; Erchegyi, J.; Reubi, J.; Rivier, J.; Riek, R.. "Somatostatin receptor 1 selective analogues: 4. Three-dimensional consensus structure by NMR" J. Med. Chem. 48, 523-533 (2005).
Assembly members:
somatostatin, polymer, 12 residues, 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):
somatostatin: YCKFEXXTFXSC
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 70 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | SST1-selective somatostatin analog | 1 |
Entities:
Entity 1, SST1-selective somatostatin analog 12 residues - Formula weight is not available
| 1 | TYR | CYS | LYS | PHE | GLU | DTR | IAM | THR | PHE | HHK | ||||
| 2 | SER | CYS |
Samples:
sample_1: somatostatin 2.5 mM; DMSO-d6 100%
sample_cond_1: pH: 7.0; pressure: 1 atm; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| DQF-COSY | sample_1 | not available | sample_cond_1 |
| 2D NOESY | sample_1 | not available | sample_cond_1 |
Software:
DYANA v1.0.6 - refinement, structure solution
NMR spectrometers:
- Bruker AVANCE 750 MHz