BMRB Entry 6090
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR6090
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NMR-STAR v3 text file.
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Title: 1H, 13C and 15N resonance assignement of the reduced form of methionine sulfoxide reductase A from Escherichia coli
Deposition date: 2004-02-04 Original release date: 2005-04-29
Authors: Coudevylle, Nicolas; Thureau, Aurelien; Azza, Said; Boshi-Muller, Sandrine; Branlant, Guy; Cung, Manh-Thong
Citation: Coudevylle, Nicolas; Thureau, Aurelien; Azza, Said; Boshi-Muller, Sandrine; Branlant, Guy; Cung, Manh-Thong. "Letter to the Editor: 1H, 13C and 15N resonance assignement of the reduced form of methionine sulfoxide reductase A from Escherichia coli" J. Biomol. NMR 30, 363-364 (2004).
Assembly members:
Methionine sulfoxide reductase A, polymer, 211 residues, Formula weight is not available
Natural source: Common Name: Esherichia coli Taxonomy ID: 562 Superkingdom: Eubacteria Kingdom: not available Genus/species: Esherichia coli
Experimental source: Production method: recombinant technology
Entity Sequences (FASTA):
Methionine sulfoxide reductase A: SLFDKKHLVSPADALPGRNT
PMPVATLHAVNGHSMTNVPD
GMEIAIFAMGCFWGVERLFW
QLPGVYSTAAGYTGGYTPNP
TYREVCSGDTGHAEAVRIVY
DPSVISYEQLLQVFWENHDP
AQGMRQGNDHGTQYRSAIYP
LTPEQDAAARASLERFQAAM
LAADDDRHITTEIANATPFY
YAEDDHQQYLHKNPYGYCGI
GGIGVCLPPEA
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 795 |
| 13C chemical shifts | 651 |
| 15N chemical shifts | 184 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | MsrA | 1 |
Entities:
Entity 1, MsrA 211 residues - Formula weight is not available
| 1 | SER | LEU | PHE | ASP | LYS | LYS | HIS | LEU | VAL | SER | ||||
| 2 | PRO | ALA | ASP | ALA | LEU | PRO | GLY | ARG | ASN | THR | ||||
| 3 | PRO | MET | PRO | VAL | ALA | THR | LEU | HIS | ALA | VAL | ||||
| 4 | ASN | GLY | HIS | SER | MET | THR | ASN | VAL | PRO | ASP | ||||
| 5 | GLY | MET | GLU | ILE | ALA | ILE | PHE | ALA | MET | GLY | ||||
| 6 | CYS | PHE | TRP | GLY | VAL | GLU | ARG | LEU | PHE | TRP | ||||
| 7 | GLN | LEU | PRO | GLY | VAL | TYR | SER | THR | ALA | ALA | ||||
| 8 | GLY | TYR | THR | GLY | GLY | TYR | THR | PRO | ASN | PRO | ||||
| 9 | THR | TYR | ARG | GLU | VAL | CYS | SER | GLY | ASP | THR | ||||
| 10 | GLY | HIS | ALA | GLU | ALA | VAL | ARG | ILE | VAL | TYR | ||||
| 11 | ASP | PRO | SER | VAL | ILE | SER | TYR | GLU | GLN | LEU | ||||
| 12 | LEU | GLN | VAL | PHE | TRP | GLU | ASN | HIS | ASP | PRO | ||||
| 13 | ALA | GLN | GLY | MET | ARG | GLN | GLY | ASN | ASP | HIS | ||||
| 14 | GLY | THR | GLN | TYR | ARG | SER | ALA | ILE | TYR | PRO | ||||
| 15 | LEU | THR | PRO | GLU | GLN | ASP | ALA | ALA | ALA | ARG | ||||
| 16 | ALA | SER | LEU | GLU | ARG | PHE | GLN | ALA | ALA | MET | ||||
| 17 | LEU | ALA | ALA | ASP | ASP | ASP | ARG | HIS | ILE | THR | ||||
| 18 | THR | GLU | ILE | ALA | ASN | ALA | THR | PRO | PHE | TYR | ||||
| 19 | TYR | ALA | GLU | ASP | ASP | HIS | GLN | GLN | TYR | LEU | ||||
| 20 | HIS | LYS | ASN | PRO | TYR | GLY | TYR | CYS | GLY | ILE | ||||
| 21 | GLY | GLY | ILE | GLY | VAL | CYS | LEU | PRO | PRO | GLU | ||||
| 22 | ALA |
Samples:
sample_1: Methionine sulfoxide reductase A, [U-99% 13C; U-99% 15N], 0.9 mM
Ex-cond_1: pH: 7.1; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 1H-15N HSQC | not available | not available | not available |
| HNCA | not available | not available | not available |
| HN(CO)CA | not available | not available | not available |
| HNCO | not available | not available | not available |
| HN(CA)CO | not available | not available | not available |
| CBCANH | not available | not available | not available |
| CBCA(CO)NH | not available | not available | not available |
| HNHA | not available | not available | not available |
| HCCH-TOCSY | not available | not available | not available |
Software:
XWINNMR v3.1 - spectra processing
XEASY - peak peaking, spectra assignment
NMR spectrometers:
- Bruker DRX 600 MHz
Related Database Links:
| BMRB | 6786 |
| PDB | |
| DBJ | BAB38620 BAE78220 BAG80049 BAI28524 BAI33698 |
| EMBL | CAP78740 CAQ34570 CAR01194 CAR05961 CAR11177 |
| GB | AAA24399 AAA97115 AAC77176 AAG59417 AAN45686 |
| REF | NP_290851 NP_313224 NP_418640 NP_709979 NP_757164 |
| SP | A7ZV98 A8A7X5 B1ISY2 B1LRA3 B1XDW8 |
| AlphaFold | A7ZV98 A8A7X5 B1ISY2 B1LRA3 B1XDW8 |
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts