BMRB Entry 50849
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR50849
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
All files associated with the entry
Citation: Young, Brianna; Varney, Kristen; Wilder, Paul; Costabile, Brianna; Pozharski, Edwin; Cook, Mary; Godoy-Ruiz, Raquel; Clarke, Oliver; Mancia, Filippo; Weber, David. "Physiologically Relevant Free Ca 2+ Ion Concentrations Regulate STRA6-Calmodulin Complex Formation via the BP2 Region of STRA6" J. Mol. Biol. 433, 167272-167272 (2021).
PubMed: 34592217
Assembly members:
entity_1, polymer, 148 residues, Formula weight is not available
entity_MG, non-polymer, 24.305 Da.
entity_CA, non-polymer, 40.078 Da.
entity_2, polymer, 27 residues, Formula weight is not available
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET24
Entity Sequences (FASTA):
entity_1: ADQLTEEQIAEFKEAFSLFD
KDGDGTITTKELGTVMRSLG
QNPTEAELQDMINEVDADGN
GTIDFPEFLTMMARKMKDTD
SEEEIREAFRVFDKDGNGYI
SAAELRHVMTNLGEKLTDEE
VDEMIREADIDGDGQVNYEE
FVQMMTAK
entity_2: VSNAKRARAHWQLLYTLVNN
PSLVGSR
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 134 |
| 15N chemical shifts | 132 |
| 1H chemical shifts | 132 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | Calmodulin | 1 |
| 2 | Mg2+ | 2 |
| 3 | Ca2+ | 3 |
| 4 | BP2 | 4 |
Entities:
Entity 1, Calmodulin 148 residues - Formula weight is not available
| 1 | ALA | ASP | GLN | LEU | THR | GLU | GLU | GLN | ILE | ALA | ||||
| 2 | GLU | PHE | LYS | GLU | ALA | PHE | SER | LEU | PHE | ASP | ||||
| 3 | LYS | ASP | GLY | ASP | GLY | THR | ILE | THR | THR | LYS | ||||
| 4 | GLU | LEU | GLY | THR | VAL | MET | ARG | SER | LEU | GLY | ||||
| 5 | GLN | ASN | PRO | THR | GLU | ALA | GLU | LEU | GLN | ASP | ||||
| 6 | MET | ILE | ASN | GLU | VAL | ASP | ALA | ASP | GLY | ASN | ||||
| 7 | GLY | THR | ILE | ASP | PHE | PRO | GLU | PHE | LEU | THR | ||||
| 8 | MET | MET | ALA | ARG | LYS | MET | LYS | ASP | THR | ASP | ||||
| 9 | SER | GLU | GLU | GLU | ILE | ARG | GLU | ALA | PHE | ARG | ||||
| 10 | VAL | PHE | ASP | LYS | ASP | GLY | ASN | GLY | TYR | ILE | ||||
| 11 | SER | ALA | ALA | GLU | LEU | ARG | HIS | VAL | MET | THR | ||||
| 12 | ASN | LEU | GLY | GLU | LYS | LEU | THR | ASP | GLU | GLU | ||||
| 13 | VAL | ASP | GLU | MET | ILE | ARG | GLU | ALA | ASP | ILE | ||||
| 14 | ASP | GLY | ASP | GLY | GLN | VAL | ASN | TYR | GLU | GLU | ||||
| 15 | PHE | VAL | GLN | MET | MET | THR | ALA | LYS |
Entity 2, Mg2+ - Mg - 24.305 Da.
| 1 | MG |
Entity 3, Ca2+ - Ca - 40.078 Da.
| 1 | CA |
Entity 4, BP2 27 residues - Formula weight is not available
| 1 | VAL | SER | ASN | ALA | LYS | ARG | ALA | ARG | ALA | HIS | ||||
| 2 | TRP | GLN | LEU | LEU | TYR | THR | LEU | VAL | ASN | ASN | ||||
| 3 | PRO | SER | LEU | VAL | GLY | SER | ARG |
Samples:
sample_1: Calmodulin, [U-13C; U-15N], 0.5 mM; STRA6 BP2 0.6 mM; Calcium ion 9.3 mM; Magnesium ion 19 mM
sample_conditions_1: pH: 7.4; pressure: 1 atm; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
| 3D HNCA | sample_1 | isotropic | sample_conditions_1 |
| 3D HN(CO)CA | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
Software:
CcpNMR - chemical shift assignment
NMR spectrometers:
- Bruker AVANCE III 600 MHz MHz
- Bruker AVANCE III 950 MHz
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks