BMRB Entry 5029
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5029
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Title: Solution Structure of an Insect-specific Neurotoxin from the New World Scorpion Centruroides sculpturatus Ewing PubMed: 11444973
Deposition date: 2001-05-22 Original release date: 2001-06-25
Authors: Jablonsky, Michael; Jackson, Patricia; Krishna, N.
Citation: Jablonsky, Michael; Jackson, Patricia; Krishna, N.. "Solution Structure of an Insect-specific Neurotoxin from the New World Scorpion Centruroides sculpturatus Ewing(,)" Biochemistry 40, 8273-8282 (2001).
Assembly members:
Centruroides sculpturatus Ewing variant 5, polymer, 60 residues, 6354 Da.
Natural source: Common Name: bark scorpion Taxonomy ID: 6879 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Centruroides exilicauda
Experimental source: Production method: purified from the natural source
Entity Sequences (FASTA):
Centruroides sculpturatus Ewing variant 5: KDGYPVDSKGCKLSCVANNY
CDNQCKMKKASGGHCYAMSC
YCEGLPENAKVSDSATNICG
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 384 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | CsE-v5 | 1 |
Entities:
Entity 1, CsE-v5 60 residues - 6354 Da.
| 1 | LYS | ASP | GLY | TYR | PRO | VAL | ASP | SER | LYS | GLY | |
| 2 | CYS | LYS | LEU | SER | CYS | VAL | ALA | ASN | ASN | TYR | |
| 3 | CYS | ASP | ASN | GLN | CYS | LYS | MET | LYS | LYS | ALA | |
| 4 | SER | GLY | GLY | HIS | CYS | TYR | ALA | MET | SER | CYS | |
| 5 | TYR | CYS | GLU | GLY | LEU | PRO | GLU | ASN | ALA | LYS | |
| 6 | VAL | SER | ASP | SER | ALA | THR | ASN | ILE | CYS | GLY |
Samples:
sample_1: Centruroides sculpturatus Ewing variant 5 1.0 mM
Expt_Con: pH: 4.0; temperature: 303 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-1H NOESY | sample_1 | not available | Expt_Con |
Software:
felix v9.80 - assignments, processing
NMR spectrometers:
- Bruker Am 600 MHz