BMRB Entry 52070
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR52070
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NMR-STAR v3 text file.
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Citation: Kitoka, Kristine; Lends, Alons; Kucinskas, Gytis; Bula, Anna; Krasauskas, Lukas; Smirnovas, Vytautas; Zilkova, Monika; Kocacech, Branislav; Skrabana, Rostislav; Hritz, Jozef; Jaudzems, Kristaps. "dGAE(297-391) Tau Fragment Promotes Formation of Chronic Traumatic Encephalopathy-Like Tau Filaments" Angew. Chem. Int. Ed. Engl. ., .-. (2024).
PubMed: 39183704
Assembly members:
entity_1, polymer, 96 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: pET-17b
Entity Sequences (FASTA):
entity_1: MIKHVPGGGSVQIVYKPVDL
SKVTSKCGSLGNIHHKPGGG
QVEVKSEKLDFKDRVQSKIG
SLDNITHVPGGGNKKIETHK
LTFRENAKAKTDHGAE
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 313 |
| 15N chemical shifts | 69 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | dGAE | 1 |
Entities:
Entity 1, dGAE 96 residues - Formula weight is not available
| 1 | MET | ILE | LYS | HIS | VAL | PRO | GLY | GLY | GLY | SER | ||||
| 2 | VAL | GLN | ILE | VAL | TYR | LYS | PRO | VAL | ASP | LEU | ||||
| 3 | SER | LYS | VAL | THR | SER | LYS | CYS | GLY | SER | LEU | ||||
| 4 | GLY | ASN | ILE | HIS | HIS | LYS | PRO | GLY | GLY | GLY | ||||
| 5 | GLN | VAL | GLU | VAL | LYS | SER | GLU | LYS | LEU | ASP | ||||
| 6 | PHE | LYS | ASP | ARG | VAL | GLN | SER | LYS | ILE | GLY | ||||
| 7 | SER | LEU | ASP | ASN | ILE | THR | HIS | VAL | PRO | GLY | ||||
| 8 | GLY | GLY | ASN | LYS | LYS | ILE | GLU | THR | HIS | LYS | ||||
| 9 | LEU | THR | PHE | ARG | GLU | ASN | ALA | LYS | ALA | LYS | ||||
| 10 | THR | ASP | HIS | GLY | ALA | GLU |
Samples:
sample_1: dGAE(297-391) filaments, [U-100% 13C; U-100% 15N], 25 mg
sample_2: dGAE(297-391) filaments, [U-100% 13C; U-100% 15N], Lys natural abundance, 30 mg
sample_3: dGAE(297-391) filaments, [U-100% 13C; U-100% 15N], Lys, Leu, Ile, Val natural abundance, 30 mg
sample_conditions_1: ionic strength: 154 mM; pH: 7.4; pressure: 1 atm; temperature: 273 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D DARR 20 ms | sample_1 | isotropic | sample_conditions_1 |
| 2D DARR 150 ms | sample_1 | isotropic | sample_conditions_1 |
| 2D NCA | sample_1 | isotropic | sample_conditions_1 |
| 2D NCO | sample_1 | isotropic | sample_conditions_1 |
| 2D NCACX | sample_1 | isotropic | sample_conditions_1 |
| 3D NCACX | sample_1 | isotropic | sample_conditions_1 |
| 3D NCOCX | sample_1 | isotropic | sample_conditions_1 |
| 3D CANCO | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-13C INEPT | sample_1 | isotropic | sample_conditions_1 |
| 2D CAN | sample_1 | isotropic | sample_conditions_1 |
| 2D CON | sample_1 | isotropic | sample_conditions_1 |
| 2D DARR 20 ms | sample_2 | isotropic | sample_conditions_1 |
| 2D DARR 500 ms | sample_2 | isotropic | sample_conditions_1 |
| 2D NCA | sample_2 | isotropic | sample_conditions_1 |
| 2D NCO | sample_2 | isotropic | sample_conditions_1 |
| 2D NCACX | sample_2 | isotropic | sample_conditions_1 |
| 3D NCOCX | sample_2 | isotropic | sample_conditions_1 |
| 2D DARR 20 ms | sample_3 | isotropic | sample_conditions_1 |
| 2D DARR 100 ms | sample_3 | isotropic | sample_conditions_1 |
| 2D DARR 500 ms | sample_3 | isotropic | sample_conditions_1 |
| 2D NCA | sample_3 | isotropic | sample_conditions_1 |
| 2D NCO | sample_3 | isotropic | sample_conditions_1 |
| 2D NCACX | sample_3 | isotropic | sample_conditions_1 |
Software:
TOPSPIN v3.6.3 - collection, processing
CcpNMR v3.1.0 - chemical shift assignment, peak picking
NMR spectrometers:
- Bruker AVANCE III 800 MHz