BMRB Entry 7066
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR7066
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
All files associated with the entry
Citation: Banci, L.; Bertini, I.; Cantini, F.; Ciofi-Baffoni, S.; Cavet, J.; Dennison, C.; Graham, A.; Harvie, D.; Robinson, N.. "NMR structural analysis of cadmium sensing by winged helix repressor CmtR" J. Biol. Chem. 282, 30181-30188 (2007).
PubMed: 17599915
Assembly members:
CmtR, polymer, 118 residues, Formula weight is not available
CD, non-polymer, 112.411 Da.
Natural source: Common Name: Mycobacterium tuberculosis Taxonomy ID: 1773 Superkingdom: Bacteria Kingdom: not available Genus/species: Mycobacterium tuberculosis
Experimental source: Production method: recombinant technology
Entity Sequences (FASTA):
CmtR: MLTCEMRESALARLGRALAD
PTRCRILVALLDGVCYPGQL
AAHLGLTRSNVSNHLSCLRG
CGLVVATYEGRQVRYALADS
HLARALGELVQVVLAVDTDQ
PCVAERAASGEAVEMTGS
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 309 |
| 15N chemical shifts | 102 |
| 1H chemical shifts | 643 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | CmtR chain A | 1 |
| 2 | CmtR chain B | 1 |
| 3 | CADMIUM (II) ION 1 | 2 |
| 4 | CADMIUM (II) ION 2 | 2 |
Entities:
Entity 1, CmtR chain A 118 residues - Formula weight is not available
| 1 | MET | LEU | THR | CYS | GLU | MET | ARG | GLU | SER | ALA | ||||
| 2 | LEU | ALA | ARG | LEU | GLY | ARG | ALA | LEU | ALA | ASP | ||||
| 3 | PRO | THR | ARG | CYS | ARG | ILE | LEU | VAL | ALA | LEU | ||||
| 4 | LEU | ASP | GLY | VAL | CYS | TYR | PRO | GLY | GLN | LEU | ||||
| 5 | ALA | ALA | HIS | LEU | GLY | LEU | THR | ARG | SER | ASN | ||||
| 6 | VAL | SER | ASN | HIS | LEU | SER | CYS | LEU | ARG | GLY | ||||
| 7 | CYS | GLY | LEU | VAL | VAL | ALA | THR | TYR | GLU | GLY | ||||
| 8 | ARG | GLN | VAL | ARG | TYR | ALA | LEU | ALA | ASP | SER | ||||
| 9 | HIS | LEU | ALA | ARG | ALA | LEU | GLY | GLU | LEU | VAL | ||||
| 10 | GLN | VAL | VAL | LEU | ALA | VAL | ASP | THR | ASP | GLN | ||||
| 11 | PRO | CYS | VAL | ALA | GLU | ARG | ALA | ALA | SER | GLY | ||||
| 12 | GLU | ALA | VAL | GLU | MET | THR | GLY | SER |
Entity 2, CADMIUM (II) ION 1 - Cd - 112.411 Da.
| 1 | CD |
Samples:
sample_1: CmtR 1 mM; phosphate buffer 50 mM; NaCl 50 mM; DTT 3 mM; H2O 90%; D2O 10%
sample_2: CmtR, [U-15N], 1 mM; phosphate buffer 50 mM; NaCl 50 mM; DTT 3 mM; H2O 90%; D2O 10%
sample_3: CmtR, [U-15N; U-13C], 1 mM; phosphate buffer 50 mM; NaCl 50 mM; DTT 3 mM; H2O 90%; D2O 10%
sample_cond_1: ionic strength: 50 mM; pH: 7; pressure: 1 atm; temperature: 312 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D NOESY | not available | not available | sample_cond_1 |
| 3D 15N-separated NOESY | not available | not available | sample_cond_1 |
| HNCA | not available | not available | sample_cond_1 |
| HN(CO)CA | not available | not available | sample_cond_1 |
| CBCA(CO)NH | not available | not available | sample_cond_1 |
| HNCO | not available | not available | sample_cond_1 |
| 3D 13C-separated NOESY | not available | not available | sample_cond_1 |
| CCH-TOCSY | not available | not available | sample_cond_1 |
Software:
xwinnmr v3.1 - processing
XEASY v1.3 - data analysis
CARA v1.4 - data analysis
CYANA v1.1 - structure solution
AMBER v8.0 - refinement
NMR spectrometers:
- Bruker AVANCE 800 MHz
Related Database Links:
| PDB | |
| DBJ | BAH26291 BAL65990 BAQ06044 GAA45697 |
| EMBL | CAD96870 CAL71999 CCC27076 CCC44346 CCC64589 |
| GB | AAK46327 ABQ73769 ABR06361 ACT25060 AEB04132 |
| REF | NP_216510 NP_336513 NP_855667 WP_003410018 WP_003903707 |
| SP | P67732 P9WMI8 P9WMI9 |
| AlphaFold | P67732 P9WMI8 P9WMI9 |
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks