BMRB Entry 4233
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR4233
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Title: 1H Chemical Shift Assignments for Omega-Atracotoxin-Hv1a
Deposition date: 1998-09-28 Original release date: 2003-02-27
Authors: Fletcher, Jamie; O'Donoghue, Sean; Nilges, Michael; King, Glenn
Citation: Fletcher, Jamie; Smith, Ross; O'Donoghue, Sean; Nilges, Michael; Connor, Mark; Howden, Merlin; Christie, MacDonald; King, Glenn. "The Structure of a Novel Insecticidal Neurotoxin, Omega-Atracotoxin-Hv1a, from the Venom of an Australian Funnel Web Spider" Nature Struct. Biol. 4, 559-566 (1997).
Assembly members:
omega-atracotoxin-Hv1a, polymer, 37 residues, Formula weight is not available
Natural source: Common Name: Blue Mountains funnel web spider Taxonomy ID: 6904 Superkingdom: eucaryota Kingdom: metazoa Genus/species: Hadronyche versuta
Experimental source: Production method: chemically synthesized
Entity Sequences (FASTA):
omega-atracotoxin-Hv1a: SPTCIPSGQPCPYNENCCSQ
SCTFKENENGNTVKRCD
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 226 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | actx | 1 |
Entities:
Entity 1, actx 37 residues - Formula weight is not available
| 1 | SER | PRO | THR | CYS | ILE | PRO | SER | GLY | GLN | PRO | ||||
| 2 | CYS | PRO | TYR | ASN | GLU | ASN | CYS | CYS | SER | GLN | ||||
| 3 | SER | CYS | THR | PHE | LYS | GLU | ASN | GLU | ASN | GLY | ||||
| 4 | ASN | THR | VAL | LYS | ARG | CYS | ASP |
Samples:
sample_one: omega-atracotoxin-Hv1a 3 mM; H2O 95%; D2O 5%
sample_conditions_one: pH: 2.9; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 1H TOCSY | sample_one | not available | not available |
| 1H NOESY | sample_one | not available | not available |
| DQF-COSY | sample_one | not available | not available |
| ECOSY | sample_one | not available | not available |
Software:
UXNMR - Spectra processing
NMR spectrometers:
- Bruker AMX 600 MHz