BMRB Entry 7285
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR7285
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Title: 1H, 13C and 15N assignments for a double dockerin domain PubMed: 17869267
Deposition date: 2006-09-01 Original release date: 2007-10-09
Authors: Tunnicliffe, Richard; Williamson, Mike; Higgins, Lee
Citation: Nagy, Tibor; Tunnicliffe, Richard; Higgins, Lee; Walters, Chris; Gilbert, Harry; Williamson, Mike. "Characterization of a double dockerin from the cellulosome of the anaerobic fungus Piromyces equi" J. Mol. Biol. 373, 612-622 (2007).
Assembly members:
double dockerin, polymer, 96 residues, Formula weight is not available
Natural source: Common Name: Piromyces equi Taxonomy ID: 99929 Superkingdom: Eukaryota Kingdom: Fungi Genus/species: Piromyces equi
Experimental source: Production method: recombinant technology
Entity Sequences (FASTA):
double dockerin: MACWAQSQGYNCCNNPSSTK
VEYTDASGQWGVQNGQWCGI
DYSYGQNQGNESCTGNGSYP
CCNTCQATYTDGDGDWAFEN
GNWCGIKNSCKQQPQN
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 375 |
| 15N chemical shifts | 118 |
| 1H chemical shifts | 571 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | double dockerin | 1 |
Entities:
Entity 1, double dockerin 96 residues - Formula weight is not available
| 1 | MET | ALA | CYS | TRP | ALA | GLN | SER | GLN | GLY | TYR | ||||
| 2 | ASN | CYS | CYS | ASN | ASN | PRO | SER | SER | THR | LYS | ||||
| 3 | VAL | GLU | TYR | THR | ASP | ALA | SER | GLY | GLN | TRP | ||||
| 4 | GLY | VAL | GLN | ASN | GLY | GLN | TRP | CYS | GLY | ILE | ||||
| 5 | ASP | TYR | SER | TYR | GLY | GLN | ASN | GLN | GLY | ASN | ||||
| 6 | GLU | SER | CYS | THR | GLY | ASN | GLY | SER | TYR | PRO | ||||
| 7 | CYS | CYS | ASN | THR | CYS | GLN | ALA | THR | TYR | THR | ||||
| 8 | ASP | GLY | ASP | GLY | ASP | TRP | ALA | PHE | GLU | ASN | ||||
| 9 | GLY | ASN | TRP | CYS | GLY | ILE | LYS | ASN | SER | CYS | ||||
| 10 | LYS | GLN | GLN | PRO | GLN | ASN |
Samples:
sample_1: double dockerin, [U-95% 13C; U-90% 15N], 0.8 mM; sodium phosphate 50 mM
conditions_1: pH: 6.5; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 15N-1H | sample_1 | not available | conditions_1 |
| 13C-1H HSQC | sample_1 | not available | conditions_1 |
| 3D HNCO | sample_1 | not available | conditions_1 |
| HN(CA)CO | sample_1 | not available | conditions_1 |
| CBCA(CO)NH | sample_1 | not available | conditions_1 |
| HNCACB | sample_1 | not available | conditions_1 |
| HNCA | sample_1 | not available | conditions_1 |
| HCCH-TOCSYm | sample_1 | not available | conditions_1 |
| CCH-TOCSY | sample_1 | not available | conditions_1 |
| 13C/15N-edited NOESY | sample_1 | not available | conditions_1 |
Software:
FELIX v2004, Accelrys Inc -
NMR spectrometers:
- Bruker DRX 500 MHz
- Bruker DRX 600 MHz
- Bruker DRX 800 MHz
Download simulated HSQC data in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts