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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/BMR30643
MolProbity Validation Chart
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NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
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Citation: Rao, S.; Horne, W.. "Proteomimetic Zinc Finger Domains with Modified Metal-binding beta-Turns" Pept. Sci. (Hoboken) 112, e24177-e24177 (2020).
PubMed: 33733039
Assembly members:
entity_1, polymer, 31 residues, 3697.285 Da.
entity_ZN, non-polymer, 65.409 Da.
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
entity_1: RPFXCTWXCGKRFTRSDELQ
RHKRTHTGEKX
Data type | Count |
1H chemical shifts | 206 |
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | entity_1 | 1 |
2 | ZINC ION | 2 |
Entity 1, entity_1 31 residues - 3697.285 Da.
1 | ARG | PRO | PHE | NLE | CYS | THR | TRP | ORN | CYS | GLY | ||||
2 | LYS | ARG | PHE | THR | ARG | SER | ASP | GLU | LEU | GLN | ||||
3 | ARG | HIS | LYS | ARG | THR | HIS | THR | GLY | GLU | LYS | ||||
4 | NH2 |
Entity 2, ZINC ION - Zn - 65.409 Da.
1 | ZN |
sample_1: entity_1 1.2 mM; TRIS, [U-2H], 10 mM; DSS 0.05 mM; zinc chloride 1.8 mM
sample_conditions_1: ionic strength: 10 mM; pH: 6 pH*; pressure: 1 atm; temperature: 298 K
Name | Sample | Sample state | Sample conditions |
---|---|---|---|
2D 1H-1H TOCSY | sample_1 | isotropic | sample_conditions_1 |
2D 1H-1H COSY | sample_1 | isotropic | sample_conditions_1 |
2D 1H-1H NOESY | sample_1 | isotropic | sample_conditions_1 |
TopSpin, Bruker Biospin - processing
Sparky, Goddard - data analysis
ARIA, Linge, O'Donoghue and Nilges - refinement, structure calculation