BMRB Entry 6948
Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR6948
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Title: Backbone 1H, 13C, and 15N Chemical Shift assignments for monomeric E. coli Ferric Uptake Regulator (Fur). PubMed: 16690618
Deposition date: 2006-01-24 Original release date: 2006-05-09
Authors: Pecqueur, Ludovic; D'Autreaux, Benoit; Brutscher, Bernhard; Michaud-Soret, Isabelle; Bersch, Beate
Citation: Pecqueur, Ludovic; D'Autreaux, Benoit; Dupuy, Jerome; Nicolet, Yvain; Jacquamet, Lilian; Brutscher, Bernhard; Michaud-Soret, Isabelle; Bersch, Beate. "Structural changes of E. coli Ferric uptake regulator during metal-dependent dimerization and activation explored by NMR and X-ray crystallography" J. Biol. Chem. 281, 21286-21295 (2006).
Assembly members:
Fur, polymer, 147 residues, 17000 Da.
Natural source: Common Name: E. coli Taxonomy ID: 562 Superkingdom: Bacteria Kingdom: not available Genus/species: Escherichia coli
Experimental source: Production method: recombinant technology Vector: pET30
Entity Sequences (FASTA):
Fur: TDNNTALKKAGLKVTLPRLK
ILEVLQEPDNHHVSAEDLYK
RLIDMGEEIGLATVYRVLNQ
FDDAGIVTRHNFEGGKSVFE
LTQQHHHDHLICLDCGKVIE
FSDDSIEARQREIAAKHGIR
LTNHSLYLYGHCAEGDCRED
EHAHEGK
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 317 |
| 15N chemical shifts | 116 |
| 1H chemical shifts | 116 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | Fur monomer | 1 |
Entities:
Entity 1, Fur monomer 147 residues - 17000 Da.
the sequence numbering corresponds to the biological unit after NMet cleavage
| 1 | THR | ASP | ASN | ASN | THR | ALA | LEU | LYS | LYS | ALA | ||||
| 2 | GLY | LEU | LYS | VAL | THR | LEU | PRO | ARG | LEU | LYS | ||||
| 3 | ILE | LEU | GLU | VAL | LEU | GLN | GLU | PRO | ASP | ASN | ||||
| 4 | HIS | HIS | VAL | SER | ALA | GLU | ASP | LEU | TYR | LYS | ||||
| 5 | ARG | LEU | ILE | ASP | MET | GLY | GLU | GLU | ILE | GLY | ||||
| 6 | LEU | ALA | THR | VAL | TYR | ARG | VAL | LEU | ASN | GLN | ||||
| 7 | PHE | ASP | ASP | ALA | GLY | ILE | VAL | THR | ARG | HIS | ||||
| 8 | ASN | PHE | GLU | GLY | GLY | LYS | SER | VAL | PHE | GLU | ||||
| 9 | LEU | THR | GLN | GLN | HIS | HIS | HIS | ASP | HIS | LEU | ||||
| 10 | ILE | CYS | LEU | ASP | CYS | GLY | LYS | VAL | ILE | GLU | ||||
| 11 | PHE | SER | ASP | ASP | SER | ILE | GLU | ALA | ARG | GLN | ||||
| 12 | ARG | GLU | ILE | ALA | ALA | LYS | HIS | GLY | ILE | ARG | ||||
| 13 | LEU | THR | ASN | HIS | SER | LEU | TYR | LEU | TYR | GLY | ||||
| 14 | HIS | CYS | ALA | GLU | GLY | ASP | CYS | ARG | GLU | ASP | ||||
| 15 | GLU | HIS | ALA | HIS | GLU | GLY | LYS |
Samples:
sample_1: FurM, [U-97% 15N; U-13C], 2 ± 0.1 mM; MOPS 100 mM; KCl 500 mM; EDTA 20 mM; D20 7%
conditions_2: pH: 7.5; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 1H15N_HSQC | sample_1 | not available | conditions_2 |
| 1H15N13C_MQ_COHNCA | sample_1 | not available | conditions_2 |
| 1H15N13C_MQ_HNCOCA | sample_1 | not available | conditions_2 |
| 1H15N13C_HNCACO | sample_1 | not available | conditions_2 |
| 1H15N13C_HN(CA)CB | sample_1 | not available | conditions_2 |
| 1H15N13C_HN(COCA)CB | sample_1 | not available | conditions_2 |
| HNCO | sample_1 | not available | conditions_2 |
Software:
FELIX v2000, Accelrys -
NMR spectrometers:
- Varian Inova 600 MHz
- Varian Inova 800 MHz
Related Database Links:
| BMRB | 6947 |
| PDB | |
| DBJ | BAA35331 BAB34137 BAG76269 BAI24074 BAI29542 |
| EMBL | CAA26429 CAD05156 CAP75172 CAQ31148 CAQ89925 |
| GB | AAB51077 AAC73777 AAG55006 AAL19637 AAN42248 |
| PIR | AB0586 |
| REF | NP_286398 NP_308741 NP_415209 NP_455254 NP_459678 |
| SP | P0A9A9 P0A9B0 P0A9B1 P45599 Q83S79 |
| AlphaFold | Q83S79 P0A9A9 P0A9B0 P0A9B1 P45599 |
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts