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PDB ID: 5k5g
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR30099
MolProbity Validation Chart
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
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Citation: Mirecka, E.; Feuerstein, S.; Gremer, L.; Schroeder, G.; Stoldt, M.; Willbold, D.; Hoyer, W.. "beta-Hairpin of Islet Amyloid Polypeptide Bound to an Aggregation Inhibitor" Sci. Rep. 6, 33474-33474 (2016).
PubMed: 27641459
Assembly members:
Islet amyloid polypeptide, polymer, 37 residues, 3909.304 Da.
HI18, polymer, 69 residues, 7804.660 Da.
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 BL21(DE3) Vector: PET302
Entity Sequences (FASTA):
Islet amyloid polypeptide: KCNTATCATQRLANFLVHSS
NNFGAILSSTNVGSNTY
HI18: MHHHHHHVNSVDNKFNKEME
SAGGEIVYLPNLNPDQLCAF
IHSIHDDPSQSANLLAEAKK
LNDAQAPKW
Data type | Count |
13C chemical shifts | 320 |
15N chemical shifts | 98 |
1H chemical shifts | 656 |
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | entity_1 | 1 |
2 | entity_2, 1 | 2 |
3 | entity_2, 2 | 2 |
Entity 1, entity_1 37 residues - 3909.304 Da.
1 | LYS | CYS | ASN | THR | ALA | THR | CYS | ALA | THR | GLN | ||||
2 | ARG | LEU | ALA | ASN | PHE | LEU | VAL | HIS | SER | SER | ||||
3 | ASN | ASN | PHE | GLY | ALA | ILE | LEU | SER | SER | THR | ||||
4 | ASN | VAL | GLY | SER | ASN | THR | TYR |
Entity 2, entity_2, 1 69 residues - 7804.660 Da.
1 | MET | HIS | HIS | HIS | HIS | HIS | HIS | VAL | ASN | SER | ||||
2 | VAL | ASP | ASN | LYS | PHE | ASN | LYS | GLU | MET | GLU | ||||
3 | SER | ALA | GLY | GLY | GLU | ILE | VAL | TYR | LEU | PRO | ||||
4 | ASN | LEU | ASN | PRO | ASP | GLN | LEU | CYS | ALA | PHE | ||||
5 | ILE | HIS | SER | ILE | HIS | ASP | ASP | PRO | SER | GLN | ||||
6 | SER | ALA | ASN | LEU | LEU | ALA | GLU | ALA | LYS | LYS | ||||
7 | LEU | ASN | ASP | ALA | GLN | ALA | PRO | LYS | TRP |
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