BMRB Entry 5273
Click here to enlarge.
PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5273
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
Title: 1H chemical shift assignments for SGCI[L30R, K31M]
Deposition date: 2002-02-05 Original release date: 2002-03-29
Authors: Gaspari, Zoltan; Patthy, Andras; Graf, Laszlo; Patthy, Andras
Citation: Gaspari, Zoltan; Patthy, Andras; Graf, Laszlo; Patthy, Andras. "Comparative structure analysis of proteinase inhibitors from the desert locust, Schistocerca gregaria" Eur. J. Biochem. 269, 527-537 (2002).
Assembly members:
Schistocerca gregaria chymotrypsin inhibitor, polymer, 35 residues, Formula weight is not available
Natural source: Common Name: desert locust Taxonomy ID: 7010 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Schistocerca gregaria
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
Schistocerca gregaria chymotrypsin inhibitor: EVTCEPGTTFKDKCNTCRCG
SDGKSAACTRMACPQ
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 186 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | SGCI[L30R,K31M] | 1 |
Entities:
Entity 1, SGCI[L30R,K31M] 35 residues - Formula weight is not available
| 1 | GLU | VAL | THR | CYS | GLU | PRO | GLY | THR | THR | PHE | ||||
| 2 | LYS | ASP | LYS | CYS | ASN | THR | CYS | ARG | CYS | GLY | ||||
| 3 | SER | ASP | GLY | LYS | SER | ALA | ALA | CYS | THR | ARG | ||||
| 4 | MET | ALA | CYS | PRO | GLN |
Samples:
sample_1: Schistocerca gregaria chymotrypsin inhibitor 2.8 mM
ex-cond_1: pH: 3.0; temperature: 292 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D TOCSY | not available | not available | not available |
| 2D NOESY | not available | not available | not available |
Software:
TRIAD (SYBYL) v6.6, Tripos, Inc. - peak assignment
NMR spectrometers:
- Bruker DRX 500 MHz
Related Database Links:
| PDB |