BMRB Entry 50691
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR50691
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Title: Chemical shift assignment of thorarchaeota profilings PubMed: 35429148
Deposition date: 2021-01-05 Original release date: 2021-07-07
Authors: Chi, Celestine
Citation: Inturi, Raviteja; Lara, Sandra; Derweesh, Mahmoud; Chi, Celestine. "Structural Characterization of a Thorarchaeota Profilin Indicates Eukaryotic-Like Features but with an Extended N-Terminus" Adv. Biol. (Weinh) 6, e2101323-e2101323 (2022).
Assembly members:
entity_1, polymer, 145 residues, Formula weight is not available
Natural source: Common Name: E. coli Taxonomy ID: 562 Superkingdom: Bacteria Kingdom: not available Genus/species: Escherichia coli
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET28a
Entity Sequences (FASTA):
entity_1: GMAGYNLGTEWISLRSKLEM
SDPVMEAYTQAYEASNQMVQ
AFGVIKADGSVLWQSNNWDL
SADAQQLISAVNNQSASVKQ
NDVKYSTIRTSPESLVARNV
QGNGTLILARIEDDKWVVAW
ASADAAPDSVYVDIDRAAKA
LKGKI
- assigned_chemical_shifts
- spectral_peak_list
| Data type | Count |
| 13C chemical shifts | 261 |
| 15N chemical shifts | 136 |
| 1H chemical shifts | 808 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | Thorarchaeota profilin | 1 |
Entities:
Entity 1, Thorarchaeota profilin 145 residues - Formula weight is not available
| 1 | GLY | MET | ALA | GLY | TYR | ASN | LEU | GLY | THR | GLU | ||||
| 2 | TRP | ILE | SER | LEU | ARG | SER | LYS | LEU | GLU | MET | ||||
| 3 | SER | ASP | PRO | VAL | MET | GLU | ALA | TYR | THR | GLN | ||||
| 4 | ALA | TYR | GLU | ALA | SER | ASN | GLN | MET | VAL | GLN | ||||
| 5 | ALA | PHE | GLY | VAL | ILE | LYS | ALA | ASP | GLY | SER | ||||
| 6 | VAL | LEU | TRP | GLN | SER | ASN | ASN | TRP | ASP | LEU | ||||
| 7 | SER | ALA | ASP | ALA | GLN | GLN | LEU | ILE | SER | ALA | ||||
| 8 | VAL | ASN | ASN | GLN | SER | ALA | SER | VAL | LYS | GLN | ||||
| 9 | ASN | ASP | VAL | LYS | TYR | SER | THR | ILE | ARG | THR | ||||
| 10 | SER | PRO | GLU | SER | LEU | VAL | ALA | ARG | ASN | VAL | ||||
| 11 | GLN | GLY | ASN | GLY | THR | LEU | ILE | LEU | ALA | ARG | ||||
| 12 | ILE | GLU | ASP | ASP | LYS | TRP | VAL | VAL | ALA | TRP | ||||
| 13 | ALA | SER | ALA | ASP | ALA | ALA | PRO | ASP | SER | VAL | ||||
| 14 | TYR | VAL | ASP | ILE | ASP | ARG | ALA | ALA | LYS | ALA | ||||
| 15 | LEU | LYS | GLY | LYS | ILE |
Samples:
sample_1: Thorarchaeota profilin, [U-100% 13C; U-100% 15N], 0.5 mM
sample_conditions_1: ionic strength: 0.1 M; pH: 6.5; pressure: 1 atm; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
| 3D CBCA(CO)NH | sample_1 | isotropic | sample_conditions_1 |
| 3D HBHA(CO)NH | sample_1 | isotropic | sample_conditions_1 |
| 3D HNCA | sample_1 | isotropic | sample_conditions_1 |
| 3D HBHA(CO)NH | sample_1 | isotropic | sample_conditions_1 |
| 3D 1H-15N NOESY | sample_1 | isotropic | sample_conditions_1 |
| 3D 1H-13C NOESY | sample_1 | isotropic | sample_conditions_1 |
Software:
CcpNmr Analysis v2.14 - chemical shift assignment
NMR spectrometers:
- Bruker AVANCE NEO 600 MHz
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts