BMRB Entry 17561
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                Entry in NMR Restraints Grid
                Validation report in NRG-CING
            Chem Shift validation:  AVS_full
BMRB Entry DOI: doi:10.13018/BMR17561
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Title: Solution Structure of the Dimeric Form of a Unliganded Bovine Neurophysin, Minimized Average Structure
Deposition date: 2011-03-31 Original release date: 2012-04-03
Authors: Lee, Hunjoong; Naik, Mandar; Nguyen, Tam; Bracken, Clay; Breslow, Esther
Citation: Lee, Hunjoong; Naik, Mandar; Bracken, Clay; Breslow, Esther. "Structural Basis of the Dimerization-Induced Increase in Neurophysin-Hormone Affinity: Interplay of Inter-Domain and Inter-Subunit Interactions" Not known ., .-..
Assembly members:
Bovine Neurophysin, polymer, 92 residues,   9295.494 Da.
Natural source: Common Name: cow Taxonomy ID: 9913 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Bos taurus
Experimental source: Production method: recombinant technology Host organism: Escherichia coli
Entity Sequences (FASTA):
Bovine Neurophysin: AVLDLDVRTCLPCGPGGKGR
CFGPSICCGDELGCFVGTAE
ALRCQEENYLPSPCQSGQKP
CGSGGRCAAAGICCSPDGCH
EDPACDPEAAFS
- assigned_chemical_shifts
 
| Data type | Count | 
| 13C chemical shifts | 86 | 
| 15N chemical shifts | 154 | 
| 1H chemical shifts | 708 | 
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID | 
|---|---|---|
| 1 | Neurophysin, 1 | 1 | 
| 2 | Neurophysin, 2 | 1 | 
Entities:
Entity 1, Neurophysin, 1 92 residues - 9295.494 Da.
| 1 | ALA | VAL | LEU | ASP | LEU | ASP | VAL | ARG | THR | CYS | ||||
| 2 | LEU | PRO | CYS | GLY | PRO | GLY | GLY | LYS | GLY | ARG | ||||
| 3 | CYS | PHE | GLY | PRO | SER | ILE | CYS | CYS | GLY | ASP | ||||
| 4 | GLU | LEU | GLY | CYS | PHE | VAL | GLY | THR | ALA | GLU | ||||
| 5 | ALA | LEU | ARG | CYS | GLN | GLU | GLU | ASN | TYR | LEU | ||||
| 6 | PRO | SER | PRO | CYS | GLN | SER | GLY | GLN | LYS | PRO | ||||
| 7 | CYS | GLY | SER | GLY | GLY | ARG | CYS | ALA | ALA | ALA | ||||
| 8 | GLY | ILE | CYS | CYS | SER | PRO | ASP | GLY | CYS | HIS | ||||
| 9 | GLU | ASP | PRO | ALA | CYS | ASP | PRO | GLU | ALA | ALA | ||||
| 10 | PHE | SER | 
Samples:
sample_1: Bovine Neurophysin, [U-100% 15N], 1 mM
sample_conditions_1: pH: 2.7; pressure: 1 atm; temperature: 308 K
sample_conditions_2: pH: 2.7; pressure: 1 atm; temperature: 298 K
sample_conditions_3: ionic strength: 10.15 mM; pH: 2.7; pressure: 1 atm; temperature: 314 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 | 
| 3D HNCA | sample_1 | isotropic | sample_conditions_1 | 
| 3D HN(CO)CA | sample_1 | isotropic | sample_conditions_1 | 
| 3D HNCACB | sample_1 | isotropic | sample_conditions_1 | 
| 3D HNHA | sample_1 | isotropic | sample_conditions_1 | 
| 3D HNCO | sample_1 | isotropic | sample_conditions_1 | 
| 3D 1H-15N NOESY | sample_1 | isotropic | sample_conditions_1 | 
| 3D 1H-13C NOESY | sample_1 | isotropic | sample_conditions_1 | 
| 3D HCCH-TOCSY | sample_1 | isotropic | sample_conditions_1 | 
| 2D 1H-15N HSQC | sample_1 | anisotropic | sample_conditions_3 | 
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_2 | 
Software:
CNSSOLVE v1.0, Brunger, Adams, Clore, Gros, Nilges and Read - refinement
ARIA v1.0, Linge, O, . - processing
NMRPipe v1.0, Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax - processing
TALOS, Cornilescu, Delaglio and Bax - data analysis
SPARKY, Goddard - data analysis
ProcheckNMR, Laskowski and MacArthur - data analysis
NMR spectrometers:
- Varian INOVA 600 MHz
 - Bruker Avance 600 MHz
 - Bruker Avance 700 MHz
 
Related Database Links:
| BMRB | 17571 | 
| PDB | |
| DBJ | BAK09299 BAK09301 BAK09303 | 
| EMBL | CAA23448 CAA23450 CAA25462 CAA38924 CAJ81049 | 
| GB | AAA30680 AAI41998 AFU54450 ELK04017 | 
| PRF | 0904308A 1005247A 1307200B | 
| REF | NP_789825 XP_006042791 | 
| SP | P01175 P13389 | 
| TPG | DAA23107 | 
Download simulated HSQC data in one of the following formats:
            
CSV: Backbone
            or all simulated shifts
            
SPARKY: Backbone
            or all simulated shifts