BMRB Entry 34320
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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/BMR34320
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Title: Pepducin UT-Pep2 a biased allosteric agonist of Urotensin-II receptor PubMed: 34389356
Deposition date: 2018-10-11 Original release date: 2019-10-28
Authors: Carotenuto, A.; Hoang, T.; Nassour, H.; Martin, R.; Billard, E.; Myriam, L.; Novellino, E.; Tanny, J.; Fournier, A.; Hebert, T.; Chatenet, D.
Citation: Nassour, Hassan; Hoang, Tuan Anh; Martin, Ryan; Dallagnol, Juliana; Billard, etienne; Letourneau, Myriam; Novellino, Ettore; Carotenuto, Alfonso; Allen, Bruce; Tanny, Jason; Fournier, Alain; Hebert, Terence; Chatenet, David. "Lipidated peptides derived from intracellular loops 2 and 3 of the urotensin II receptor act as biased allosteric ligands" J. Biol. Chem. 297, 101057-101057 (2021).
Assembly members:
entity_1, polymer, 14 residues, 1456.692 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):
entity_1: XRPLDTVQRPKGYX
- assigned_chemical_shifts
- spectral_peak_list
Data type | Count |
1H chemical shifts | 95 |
Additional metadata:
Assembly:
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | entity_1 | 1 |
Entities:
Entity 1, entity_1 14 residues - 1456.692 Da.
1 | ACE | ARG | PRO | LEU | ASP | THR | VAL | GLN | ARG | PRO | ||||
2 | LYS | GLY | TYR | NH2 |
Samples:
sample_1: peptide 2.0 mM; DPC, [U-99% 2H], 200 mM
sample_conditions_1: ionic strength: 0 mM; pH: 5.5; pressure: 1 atm; temperature: 298 K
Experiments:
Name | Sample | Sample state | Sample conditions |
---|---|---|---|
1D 1H | sample_1 | anisotropic | sample_conditions_1 |
2D 1H-1H NOESY | sample_1 | anisotropic | sample_conditions_1 |
2D 1H-1H TOCSY | sample_1 | anisotropic | sample_conditions_1 |
2D DQF-COSY | sample_1 | anisotropic | sample_conditions_1 |
Software:
CYANA, Guntert P., Guntert, Mumenthaler and Wuthrich - refinement, structure calculation
XEASY, Bartels et al. - chemical shift assignment
NMR spectrometers:
- Varian INOVA 700 MHz