BMRB Entry 28055
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR28055
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Title: Backbone resonance assignments of N-terminal domain of p50 NF-kappaB subunit PubMed: 34056439
Deposition date: 2019-12-20 Original release date: 2020-12-21
Authors: Mukherjee, Sulakshana; Raza, Tahseen; Atreya, Hanudatta; Dadhwal, Prikshat
Citation: Raza, Tahseen; Dhaka, Nitin; Joseph, David; Dadhwal, Prikshat; Kakita, Veera Mohana Rao; Atreya, Hanudatta; Mukherjee, Sulakshana. "Insights into the NF-kappaB-DNA Interaction through NMR Spectroscopy." ACS Omega 6, 12877-12886 (2021).
Assembly members:
p50NTD, polymer, 207 residues, Formula weight is not available
Natural source: Common Name: Mouse Taxonomy ID: 10090 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Mus musculus
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pET11a
Entity Sequences (FASTA):
p50NTD: GPYLQILEQPKQRGFRFRYV
CEGPSHGGLPGASSEKNKKS
YPQVKICNYVGPAKVIVQLV
TNGKNIHLHAHSLVGKHCED
GVCTVTAGPKDMVVGFANLG
ILHVTKKKVFETLEARMTEA
CIRGYNPGLLVHSDLAYLQA
EGGGDRQLTDREKEIIRQAA
VQQTKEMDLSVVRLMFTAFL
PDSTGSFTRRLEPVVSDAIY
DSKAPNA
- assigned_chemical_shifts
Data type | Count |
13C chemical shifts | 427 |
15N chemical shifts | 158 |
1H chemical shifts | 158 |
Additional metadata:
Assembly:
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | p50NTD | 1 |
Entities:
Entity 1, p50NTD 207 residues - Formula weight is not available
The start residue is 39 of p50 NF-kappaB subunit
1 | GLY | PRO | TYR | LEU | GLN | ILE | LEU | GLU | GLN | PRO | ||||
2 | LYS | GLN | ARG | GLY | PHE | ARG | PHE | ARG | TYR | VAL | ||||
3 | CYS | GLU | GLY | PRO | SER | HIS | GLY | GLY | LEU | PRO | ||||
4 | GLY | ALA | SER | SER | GLU | LYS | ASN | LYS | LYS | SER | ||||
5 | TYR | PRO | GLN | VAL | LYS | ILE | CYS | ASN | TYR | VAL | ||||
6 | GLY | PRO | ALA | LYS | VAL | ILE | VAL | GLN | LEU | VAL | ||||
7 | THR | ASN | GLY | LYS | ASN | ILE | HIS | LEU | HIS | ALA | ||||
8 | HIS | SER | LEU | VAL | GLY | LYS | HIS | CYS | GLU | ASP | ||||
9 | GLY | VAL | CYS | THR | VAL | THR | ALA | GLY | PRO | LYS | ||||
10 | ASP | MET | VAL | VAL | GLY | PHE | ALA | ASN | LEU | GLY | ||||
11 | ILE | LEU | HIS | VAL | THR | LYS | LYS | LYS | VAL | PHE | ||||
12 | GLU | THR | LEU | GLU | ALA | ARG | MET | THR | GLU | ALA | ||||
13 | CYS | ILE | ARG | GLY | TYR | ASN | PRO | GLY | LEU | LEU | ||||
14 | VAL | HIS | SER | ASP | LEU | ALA | TYR | LEU | GLN | ALA | ||||
15 | GLU | GLY | GLY | GLY | ASP | ARG | GLN | LEU | THR | ASP | ||||
16 | ARG | GLU | LYS | GLU | ILE | ILE | ARG | GLN | ALA | ALA | ||||
17 | VAL | GLN | GLN | THR | LYS | GLU | MET | ASP | LEU | SER | ||||
18 | VAL | VAL | ARG | LEU | MET | PHE | THR | ALA | PHE | LEU | ||||
19 | PRO | ASP | SER | THR | GLY | SER | PHE | THR | ARG | ARG | ||||
20 | LEU | GLU | PRO | VAL | VAL | SER | ASP | ALA | ILE | TYR | ||||
21 | ASP | SER | LYS | ALA | PRO | ASN | ALA |
Samples:
sample_1: p50NTD, [U-13C; U-15N; U-2H], 0.9 mM; Tris 20 mM; NaCl 50 mM; DTT 1 mM
sample_2: p50NTD, [U-15N], 0.8 mM; Tris 20 mM; NaCl 50 mM; DTT 1 mM
sample_3: p50NTD, [15N-Lys], 0.3 mM; Tris 20 mM; NaCl 50 mM; DTT 1 mM
sample_4: p50NTD, [15N-Ile], 0.075 mM; Tris 20 mM; NaCl 50 mM; DTT 1 mM
sample_5: p50NTD, [U-15N, 14N-ARG], 0.3 mM; Tris 20 mM; NaCl 50 mM; DTT 1 mM
sample_conditions_1: ionic strength: 0.05 M; pH: 6.8; 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 HNCO | sample_1 | isotropic | sample_conditions_1 |
3D HNCA | sample_1 | isotropic | sample_conditions_1 |
3D HNCACB | sample_1 | isotropic | sample_conditions_1 |
3D HN(CO)CA | sample_1 | isotropic | sample_conditions_1 |
3D 1H-15N NOESY | sample_2 | isotropic | sample_conditions_1 |
2D 1H-15N HSQC | sample_3 | isotropic | sample_conditions_1 |
2D 1H-15N HSQC | sample_4 | isotropic | sample_conditions_1 |
2D 1H-15N HSQC | sample_5 | isotropic | sample_conditions_1 |
Software:
NMRPipe, Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax - processing
CARA, Keller and Wuthrich - chemical shift assignment, data analysis
TALOS, Cornilescu, Delaglio and Bax - data analysis
NMR spectrometers:
- Bruker Avance 800 MHz
- Bruker Ascend 800 MHz
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts