BMRB Entry 25904
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR25904
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NMR-STAR v3 text file.
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Citation: Dick, Markus; Hartmann, Rudolf; Weiergraeber, Oliver; Bisterfeld, Carolin; Classen, Thomas; Schwarten, Melanie; Neudecker, Philipp; Willbold, Dieter; Pietruszka, Joerg. "Mechanism-based inhibition of an aldolase at high concentrations of its natural substrate acetaldehyde: structural insights and protective strategies" Chem. Sci. 7, 4492-4502 (2016).
Assembly members:
DERA_MON, polymer, 265 residues, 28583.5691 Da.
Natural source: Common Name: Escherichia coli (strain K12) Taxonomy ID: 83333 Superkingdom: Bacteria Kingdom: not available Genus/species: Escherichia coli
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET21a
Entity Sequences (FASTA):
DERA_MON: MTDLKASSLRALKLMDLTTL
NDDDTDEKVIALCHQAKTPV
GNTAAICIYPRFIPIARETL
KEQGTPEIRIATVTNFPHGN
DDIDIALAETRAAIAWGADE
VDVVFPYRALMAGNEQVGFD
LVKACKEACAAANVLLKVII
ETGELKDEALIRKASEISIK
AGADFIKTSTGKVAVNATPE
SARIMMEVIRDMGVEKTVGF
KPAGGVRTAEDAQKYLAIAD
ELFGADWADARHYRFGASSL
LASLLKALGHGDGKSASSYH
HHHHH
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 507 |
| 15N chemical shifts | 244 |
| 1H chemical shifts | 244 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | DERA MON | 1 |
Entities:
Entity 1, DERA MON 265 residues - 28583.5691 Da.
| 1 | MET | THR | ASP | LEU | LYS | ALA | SER | SER | LEU | ARG | ||||
| 2 | ALA | LEU | LYS | LEU | MET | ASP | LEU | THR | THR | LEU | ||||
| 3 | ASN | ASP | ASP | ASP | THR | ASP | GLU | LYS | VAL | ILE | ||||
| 4 | ALA | LEU | CYS | HIS | GLN | ALA | LYS | THR | PRO | VAL | ||||
| 5 | GLY | ASN | THR | ALA | ALA | ILE | CYS | ILE | TYR | PRO | ||||
| 6 | ARG | PHE | ILE | PRO | ILE | ALA | ARG | GLU | THR | LEU | ||||
| 7 | LYS | GLU | GLN | GLY | THR | PRO | GLU | ILE | ARG | ILE | ||||
| 8 | ALA | THR | VAL | THR | ASN | PHE | PRO | HIS | GLY | ASN | ||||
| 9 | ASP | ASP | ILE | ASP | ILE | ALA | LEU | ALA | GLU | THR | ||||
| 10 | ARG | ALA | ALA | ILE | ALA | TRP | GLY | ALA | ASP | GLU | ||||
| 11 | VAL | ASP | VAL | VAL | PHE | PRO | TYR | ARG | ALA | LEU | ||||
| 12 | MET | ALA | GLY | ASN | GLU | GLN | VAL | GLY | PHE | ASP | ||||
| 13 | LEU | VAL | LYS | ALA | CYS | LYS | GLU | ALA | CYS | ALA | ||||
| 14 | ALA | ALA | ASN | VAL | LEU | LEU | LYS | VAL | ILE | ILE | ||||
| 15 | GLU | THR | GLY | GLU | LEU | LYS | ASP | GLU | ALA | LEU | ||||
| 16 | ILE | ARG | LYS | ALA | SER | GLU | ILE | SER | ILE | LYS | ||||
| 17 | ALA | GLY | ALA | ASP | PHE | ILE | LYS | THR | SER | THR | ||||
| 18 | GLY | LYS | VAL | ALA | VAL | ASN | ALA | THR | PRO | GLU | ||||
| 19 | SER | ALA | ARG | ILE | MET | MET | GLU | VAL | ILE | ARG | ||||
| 20 | ASP | MET | GLY | VAL | GLU | LYS | THR | VAL | GLY | PHE | ||||
| 21 | LYS | PRO | ALA | GLY | GLY | VAL | ARG | THR | ALA | GLU | ||||
| 22 | ASP | ALA | GLN | LYS | TYR | LEU | ALA | ILE | ALA | ASP | ||||
| 23 | GLU | LEU | PHE | GLY | ALA | ASP | TRP | ALA | ASP | ALA | ||||
| 24 | ARG | HIS | TYR | ARG | PHE | GLY | ALA | SER | SER | LEU | ||||
| 25 | LEU | ALA | SER | LEU | LEU | LYS | ALA | LEU | GLY | HIS | ||||
| 26 | GLY | ASP | GLY | LYS | SER | ALA | SER | SER | TYR | HIS | ||||
| 27 | HIS | HIS | HIS | HIS | HIS |
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