BMRB Entry 17058
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR17058
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
NMR-STAR v2.1 text file (deprecated)
XML gzip file.
RDF gzip file.
All files associated with the entry
Title: The structure of Ce(III)-Angiotensin II complex as obtained from NMR data and molecular dynamics calculations PubMed: 12763668
Deposition date: 2010-07-13 Original release date: 2010-09-08
Authors: D'Amelio, Nicola; Gaggelli, Elena; Mancini, Francesca; Molteni, Elena; Valensin, Daniela; Valensin, Gianni
Citation: D'Amelio, Nicola; Gaggelli, Elena; Gaggelli, Nicola; Mancini, Francesca; Molteni, Elena; Valensin, Daniela; Valensin, Gianni. "The structure of Ce(III)-Angiotensin II complex as obtained from NMR and molecular dynamics calculations" J. Inorg. Biochem. 95, 225-229 (2003).
Assembly members:
AngII, polymer, 6 residues, Formula weight is not available
CE, non-polymer, 140.116 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: obtained from a vendor
Entity Sequences (FASTA):
AngII: DRIHPF
Additional metadata:
Assembly:
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | AngII | 1 |
2 | CE | 2 |
Entities:
Entity 1, AngII 6 residues - Formula weight is not available
1 | ASP | ARG | ILE | HIS | PRO | PHE |
Entity 2, CE - Ce - 140.116 Da.
1 | CE |
Samples:
sample_1: AngII 5.00 mM; CE0 0.05 M; H2O 90%; D2O 10%
sample_conditions_1: pD: 4.0; pressure: 1 atm; temperature: 318 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 |
2D 1H-1H COSY | sample_1 | isotropic | sample_conditions_1 |
Software:
DYANA, Guntert, Braun and Wuthrich - molecular dynamics calculations
NMR spectrometers:
- Bruker Avance 600 MHz