BMRB Entry 5410
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5410
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Title: Solution structure of novel non-RGD containing short disintegrin by high resolution NMR PubMed: 12538900
Deposition date: 2002-07-03 Original release date: 2003-02-18
Authors: Moreno-Murciano, Paz; Monleon, Daniel; Calvete, Juan J.; Celda, Bernardo
Citation: Moreno-Murciano, Paz; Monleon, Daniel; Calvete, Juan J.; Celda, Bernardo; Marcinkiewicz, C.. "Amino Acid Sequence and Homology Modeling of Obtustatin, a Novel non-RGD-containing short Disintegrin isolated from the Venom of Vipera lebetina obtusa" Protein Sci. 12, 366-371 (2003).
Assembly members:
obtustatin, polymer, 41 residues, Formula weight is not available
Natural source: Common Name: lebetina obtusa Taxonomy ID: 8703 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Vipera lebetina obtusa
Experimental source: Production method: purified from the natural source
Entity Sequences (FASTA):
obtustatin: CTTGPCCRQCKLKPAGTTCW
KTSLTSHYCTGKSCDCPLYP
G
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 220 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | obtustatin | 1 |
Entities:
Entity 1, obtustatin 41 residues - Formula weight is not available
| 1 | CYS | THR | THR | GLY | PRO | CYS | CYS | ARG | GLN | CYS | ||||
| 2 | LYS | LEU | LYS | PRO | ALA | GLY | THR | THR | CYS | TRP | ||||
| 3 | LYS | THR | SER | LEU | THR | SER | HIS | TYR | CYS | THR | ||||
| 4 | GLY | LYS | SER | CYS | ASP | CYS | PRO | LEU | TYR | PRO | ||||
| 5 | GLY |
Samples:
Sample_1: obtustatin 1.1 mM
Cond_1: pH*: 2.5; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| mixing time TOCSYs 15,50 and 80 ms | Sample_1 | not available | Cond_1 |
| mixing time NOESYs 50, 100 and 200 ms | Sample_1 | not available | Cond_1 |
Software:
xwinnmr v3.1 - spectral processing
SPARKY v3.96 - spectral analysis
NMR spectrometers:
- Bruker AVANCEDMX 500 MHz
- Bruker AVANCEDMX 600 MHz
- Bruker AVANCEDMX 800 MHz