BMRB Entry 6888
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PDB ID: 2g0k
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full
BMRB Entry DOI: doi:10.13018/BMR6888
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: Caddick, Stephen; Muskett, Frederick; Stoneman, Rhys; Woolfson, Derek. "Synthetic ligands for apo-neocarzinostatin" J. Am. Chem. Soc. 128, 4204-4205 (2006).
PubMed: 16568976
Assembly members:
Neocarzinostatin, polymer, 122 residues, 12213 Da.
Flavone, non-polymer, 222.239 Da.
Natural source: Common Name: Streptomyces carzinostaticus Taxonomy ID: 1897 Superkingdom: Eubacteria Kingdom: Not applicable Genus/species: Streptomyces carzinostaticus
Experimental source: Production method: recombinant technology
Entity Sequences (FASTA):
Neocarzinostatin: HHHHHHLQGAAPTATVTPSS
GLSDGTVVKVAGAGLQAGTA
YDVGQCAWVDTGVLACNPAD
FSSVTADANGSASTSLTVRR
SFEGFLFDGTRWGTVDCTTA
ACQVGLSDAAGNGPEGVAIS
FN
- assigned_chemical_shifts
| Data type | Count |
| 15N chemical shifts | 117 |
| 1H chemical shifts | 621 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | Neocarzinostatin apo-protein | 1 |
| 2 | Flavone | 2 |
Entities:
Entity 1, Neocarzinostatin apo-protein 122 residues - 12213 Da.
| 1 | HIS | HIS | HIS | HIS | HIS | HIS | LEU | GLN | GLY | ALA | ||||
| 2 | ALA | PRO | THR | ALA | THR | VAL | THR | PRO | SER | SER | ||||
| 3 | GLY | LEU | SER | ASP | GLY | THR | VAL | VAL | LYS | VAL | ||||
| 4 | ALA | GLY | ALA | GLY | LEU | GLN | ALA | GLY | THR | ALA | ||||
| 5 | TYR | ASP | VAL | GLY | GLN | CYS | ALA | TRP | VAL | ASP | ||||
| 6 | THR | GLY | VAL | LEU | ALA | CYS | ASN | PRO | ALA | ASP | ||||
| 7 | PHE | SER | SER | VAL | THR | ALA | ASP | ALA | ASN | GLY | ||||
| 8 | SER | ALA | SER | THR | SER | LEU | THR | VAL | ARG | ARG | ||||
| 9 | SER | PHE | GLU | GLY | PHE | LEU | PHE | ASP | GLY | THR | ||||
| 10 | ARG | TRP | GLY | THR | VAL | ASP | CYS | THR | THR | ALA | ||||
| 11 | ALA | CYS | GLN | VAL | GLY | LEU | SER | ASP | ALA | ALA | ||||
| 12 | GLY | ASN | GLY | PRO | GLU | GLY | VAL | ALA | ILE | SER | ||||
| 13 | PHE | ASN |
Entity 2, Flavone - C15 H10 O2 - 222.239 Da.
| 1 | FLVN |
Related Database Links:
| BMRB | 1766 5343 5344 5969 695 |
| PDB | 1J5H 1J5I 1NCO 1NOA 1O5P 2G0K 2G0L |
| DBJ | BAA01764 BAB83894 |
| GB | AAB28103 AAM77994 |
| SP | P0A3R9 P0A3S0 |
| AlphaFold | P0A3R9 P0A3S0 P0A3R9 P0A3S0 |
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks