BMRB Entry 26045
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PDB ID: 2nd2
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR26045
MolProbity Validation Chart
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
All files associated with the entry
Citation: Bhardwaj, G.; Mulligan, V.; Bahl, C.; Gilmore, J.; Harvey, P.; Cheneval, O.; Buchko, G.; Pulavarti, S.; Kaas, Q.; Eletsky, A.; Huang, P.; Johnsen, W.; Greisen, P.; Rocklin, G.; Song, Y.; Linsky, T.; Watkins, A.; Rettie, S.; Xu, X.; Carter, L.; Bonneau, R.; Olson, J.; Coutsias, E.; Correnti, C.; Szyperski, T.; Craik, D.; Baker, D.. "Accurate de novo design of hyperstable constrained peptides." Nature 538, 329-335 (2016).
PubMed: 27626386
Assembly members:
HHH_06, polymer, 44 residues, 5119.8 Da.
Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: not available Kingdom: not available Genus/species: not available not available
Experimental source: Production method: recombinant technology Host organism: Escherichia coli Vector: pet15
Entity Sequences (FASTA):
HHH_06: APCEDLKERLKKLGMSEECR
QRLEKMCKEGTSEDAERMAR
NCES
- assigned_chemical_shifts
- spectral_peak_list
| Data type | Count |
| 13C chemical shifts | 155 |
| 15N chemical shifts | 49 |
| 1H chemical shifts | 303 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | HHH_06 | 1 |
Entities:
Entity 1, HHH_06 44 residues - 5119.8 Da.
| 1 | ALA | PRO | CYS | GLU | ASP | LEU | LYS | GLU | ARG | LEU | ||||
| 2 | LYS | LYS | LEU | GLY | MET | SER | GLU | GLU | CYS | ARG | ||||
| 3 | GLN | ARG | LEU | GLU | LYS | MET | CYS | LYS | GLU | GLY | ||||
| 4 | THR | SER | GLU | ASP | ALA | GLU | ARG | MET | ALA | ARG | ||||
| 5 | ASN | CYS | GLU | SER |
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks