BMRB Entry 16504
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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/BMR16504
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Title: Human cannabinoid receptor 1 - helix 7/8 peptide PubMed: 19766594
Deposition date: 2009-09-18 Original release date: 2009-11-20
Authors: Deshmukh, Lalit; Vinogradova, Olga; Makriyannis, Alexandros; Tiburu, Elvis; Tyukhtenko, Sergiy; Janero, David
Citation: Tyukhtenko, Sergiy; Tiburu, Elvis; Deshmukh, Lalit; Vinogradova, Olga; Janero, David; Makriyannis, Alexandros. "NMR solution structure of human cannabinoid receptor-1 helix 7/8 peptide: candidate electrostatic interactions and microdomain formation." Biochem. Biophys. Res. Commun. 390, 441-446 (2009).
Assembly members:
Human cannabinoid receptor 1, polymer, 40 residues, 4524.348 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):
Human cannabinoid receptor 1: TVFAFASMLCLLNSTVNPII
YALRSKDLRHAFRSMFPSAE
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 260 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | Human cannabinoid receptor 1 | 1 |
Entities:
Entity 1, Human cannabinoid receptor 1 40 residues - 4524.348 Da.
| 1 | THR | VAL | PHE | ALA | PHE | ALA | SER | MET | LEU | CYS | |
| 2 | LEU | LEU | ASN | SER | THR | VAL | ASN | PRO | ILE | ILE | |
| 3 | TYR | ALA | LEU | ARG | SER | LYS | ASP | LEU | ARG | HIS | |
| 4 | ALA | PHE | ARG | SER | MET | PHE | PRO | SER | ALA | GLU |
Samples:
sample_1: entity 1 mM; H2O 70%; TFE 30%
sample_conditions_1: pressure: 1 atm; temperature: 310 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:
AUREMOL, Bruker Biospin - data analysis
X-PLOR NIH v2.21, Schwieters, Kuszewski, Tjandra and Clore - structure solution
CNS, Brunger, Adams, Clore, Gros, Nilges and Read - refinement
NMR spectrometers:
- Bruker Avance 700 MHz