BMRB Entry 50304
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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/BMR50304
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Title: EapH1 PubMed: 37160842
Deposition date: 2020-06-04 Original release date: 2023-02-20
Authors: Pal, Indrani; Herrera, Alvaro; Mishra, Nitin; Prakash, Om
Citation: Mishra, Nitin; Pal, Indrani; Herrera, Alvaro; Dubey, Abhinav; Arthanari, Haribabu; Geisbrecht, Brian; Prakash, Om. "Complete non-proline backbone resonance assignments of the S. aureus neutrophil serine protease inhibitor, EapH1" Biomol. NMR Assign. 17, 129-134 (2023).
Assembly members:
entity_1, polymer, 114 residues, Formula weight is not available
Natural source: Common Name: Staphylococcus aureus Taxonomy ID: 1280 Superkingdom: Bacteria Kingdom: not available Genus/species: Staphylococcus aureus
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: BL21(DE3)
Entity Sequences (FASTA):
entity_1: GSTDSNNGYKELTMDGKHTV
PYTISVDGITALHRTYFVFP
ENKKVLYQEIDSKVKNELAS
QRGVTTEKINNAQTATYTLT
LNDGNKKVVNLKKNDDAKNS
IDPSTIKQIQIVVK
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 325 |
| 15N chemical shifts | 111 |
| 1H chemical shifts | 111 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | EapH1 | 1 |
Entities:
Entity 1, EapH1 114 residues - Formula weight is not available
| 1 | GLY | SER | THR | ASP | SER | ASN | ASN | GLY | TYR | LYS | ||||
| 2 | GLU | LEU | THR | MET | ASP | GLY | LYS | HIS | THR | VAL | ||||
| 3 | PRO | TYR | THR | ILE | SER | VAL | ASP | GLY | ILE | THR | ||||
| 4 | ALA | LEU | HIS | ARG | THR | TYR | PHE | VAL | PHE | PRO | ||||
| 5 | GLU | ASN | LYS | LYS | VAL | LEU | TYR | GLN | GLU | ILE | ||||
| 6 | ASP | SER | LYS | VAL | LYS | ASN | GLU | LEU | ALA | SER | ||||
| 7 | GLN | ARG | GLY | VAL | THR | THR | GLU | LYS | ILE | ASN | ||||
| 8 | ASN | ALA | GLN | THR | ALA | THR | TYR | THR | LEU | THR | ||||
| 9 | LEU | ASN | ASP | GLY | ASN | LYS | LYS | VAL | VAL | ASN | ||||
| 10 | LEU | LYS | LYS | ASN | ASP | ASP | ALA | LYS | ASN | SER | ||||
| 11 | ILE | ASP | PRO | SER | THR | ILE | LYS | GLN | ILE | GLN | ||||
| 12 | ILE | VAL | VAL | LYS |
Samples:
sample_1: EapH1, [U-100% 13C; U-100% 15N], 800 uM
sample_conditions_1: pH: 6.6; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-15N HSQC | 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 HCACO | sample_1 | isotropic | sample_conditions_1 |
| 3D HN(CO)CA | sample_1 | isotropic | sample_conditions_1 |
Software:
CARA - chemical shift assignment
NMR spectrometers:
- Varian INOVA 700 MHz
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts