BMRB Entry 25465
Click here to enlarge.
PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR25465
MolProbity Validation Chart
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: ConRlBNQO PubMed: 26048991
Deposition date: 2015-02-04 Original release date: 2015-06-15
Authors: Yuan, Yue
Citation: Kunda, Shailaja; Yuan, Yue; Balsara, Rashna; Zajicek, Jaroslav; Castellino, Francis. "Hydroxyproline-induced Helical Disruption in Conantokin Rl-B Affects Subunit-selective Antagonistic Activities toward Ion Channels of N-Methyl-d-aspartate Receptors" J. Biol. Chem. 290, 18156-18172 (2015).
Assembly members:
entity, polymer, 18 residues, 2113.162 Da.
Natural source: Common Name: geography cone Taxonomy ID: 6491 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Conus geographus
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
entity: GEXXLAXNQXFARXLANX
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 67 |
| 15N chemical shifts | 19 |
| 1H chemical shifts | 105 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | entity | 1 |
Entities:
Entity 1, entity 18 residues - 2113.162 Da.
| 1 | GLY | GLU | CGU | CGU | LEU | ALA | CGU | ASN | GLN | CGU | ||||
| 2 | PHE | ALA | ARG | CGU | LEU | ALA | ASN | NH2 |
Samples:
sample_1: entity, [U-100% 13C; U-100% 15N], 2.0 mM; HEPES, [U-100% 2H], 10 mM; DSS 0.1%; magnesium chloride 40 mM; sodium chloride 10 mM; H2O 90%; D2O 10%
sample_conditions_1: pH: 7; pressure: 1 atm; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-13C HSQC | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-1H TOCSY | sample_1 | isotropic | sample_conditions_1 |
| 2D DQF-COSY | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-1H NOESY | sample_1 | isotropic | sample_conditions_1 |
Software:
X-PLOR_NIH, Schwieters, Kuszewski, Tjandra and Clore - structure solution
TOPSPIN, Bruker Biospin - chemical shift assignment
SPARKY, Goddard - peak picking
Procheck, Laskowski, MacArthur, Smith, Jones, Hutchinson, Morris, Moss and Thornton - structure solution
TALOS, Cornilescu, Delaglio and Bax - data analysis
NMR spectrometers:
- Bruker Avance 800 MHz
Download simulated HSQC data in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts