BMRB Entry 20039
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR20039
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Citation: Beierle, John; Horne, W. Seth; van Maarseveen, Jan; Waser, Beatrice; Reubi, Jean Claude; Ghadiri, M. Reza. "Conformationally Homogeneous Heterocyclic Pseudotetrapeptides as
Three-Dimensional Scaffolds for Rational Drug Design: Receptor-Selective
Somatostatin Analogues" Angew. Chem., Int. Ed. 48, 4725-4729 (2009).
PubMed: 19266506
Assembly members:
14FWdKT, polymer, 4 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: recombinant technology
Entity Sequences (FASTA):
14FWdKT: FWXT
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 31 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | 14FWdKT | 1 |
Entities:
Entity 1, 14FWdKT 4 residues - Formula weight is not available
| 1 | PHE | TRP | DLY | THR |
Samples:
sample_1: cyclo[1,4-1,2,3-triazole-L-Phe-L-Trp-D-Lys-L-Thr]7 – 12 mM
sample_conditions_1: pH: .; temperature: 295 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-1H ROESY | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-1H TOCSY | sample_1 | isotropic | sample_conditions_1 |
Software:
CNS, Brunger, Adams, Clore, Gros, Nilges and Read - structure solution
NMR spectrometers:
- Bruker DRX 600 MHz