BMRB Entry 53823
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR53823
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
All files associated with the entry
Citation: Maillie, Colleen; Zhang, Minghao; Goset, Nadia; Goldenfeld, George; Kroon, Gerard; Ward, Andrew; Mravic, Marco. "Programmed inhibition of an innate immune receptor via de novo designed transmembrane proteins" .
Assembly members:
entity_1, polymer, 79 residues, Formula weight is not available
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET28
Entity Sequences (FASTA):
entity_1: MHHHHHHGSDSERERPGLVP
RGSADHDAPQMNKTIIGVSV
LSVLVVSVVAVLVYKFYFHL
MLLAGCIKYGRGENHEWRE
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 57 |
| 15N chemical shifts | 30 |
| 1H chemical shifts | 30 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | TLR4-TMJM | 1 |
Entities:
Entity 1, TLR4-TMJM 79 residues - Formula weight is not available
Residues 628-672 of TLR4, the TM-JM region, flanked by polar fragments for handling.
| 1 | MET | HIS | HIS | HIS | HIS | HIS | HIS | GLY | SER | ASP | ||||
| 2 | SER | GLU | ARG | GLU | ARG | PRO | GLY | LEU | VAL | PRO | ||||
| 3 | ARG | GLY | SER | ALA | ASP | HIS | ASP | ALA | PRO | GLN | ||||
| 4 | MET | ASN | LYS | THR | ILE | ILE | GLY | VAL | SER | VAL | ||||
| 5 | LEU | SER | VAL | LEU | VAL | VAL | SER | VAL | VAL | ALA | ||||
| 6 | VAL | LEU | VAL | TYR | LYS | PHE | TYR | PHE | HIS | LEU | ||||
| 7 | MET | LEU | LEU | ALA | GLY | CYS | ILE | LYS | TYR | GLY | ||||
| 8 | ARG | GLY | GLU | ASN | HIS | GLU | TRP | ARG | GLU |
Samples:
sample_1: TLR4 TMJM fragment, [U-100% 13C; U-100% 15N], 0.2 mM; DPC, [U-99% 2H], 30 mM; DTT 5 mM; EDTA 0.5 mM; sodium phosphate 50 mM; sodium c 50 mM
sample_conditions_1: ionic strength: 0.05 M; pH: 6; pressure: 1 atm; temperature: 313 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-15N TROSY | sample_1 | isotropic | sample_conditions_1 |
| 3D HNCA | sample_1 | isotropic | sample_conditions_1 |
| 3D HN(CO)CA | sample_1 | isotropic | sample_conditions_1 |
| 3D HNCACB | sample_1 | isotropic | sample_conditions_1 |
Software:
TOPSPIN - collection
NMRView - chemical shift assignment
NMR spectrometers:
- Bruker AVANCE III 800 MHz
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks