BMRB Entry 7078
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR7078
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Title: 1H Chemical Shift Assigments for a Potent Bowman-Birk Inhibitor from Lentil seeds PubMed: 16889634
Deposition date: 2006-04-19 Original release date: 2006-09-08
Authors: Ragg, Enzio; Galbusera, Valerio; Scarafoni, Alessio; Negri, Armando; Tedeschi, Gabriella; Consonni, Alessandro; Sessa, Fabio; Duranti, Marcello
Citation: Ragg, Enzio; Galbusera, Valerio; Scarafoni, Alessio; Negri, Armando; Tedeschi, Gabriella; Consonni, Alessandro; Sessa, Fabio; Duranti, Marcello. "Inhibitory Properties and Solution Structure of a Potent Bowman-Birk Protease Inhibitor from Lentil (Lens culinaris, L.) Seeds" FEBS J. 273, 4024-4039 (2006).
Assembly members:
Bowman-Birk Inhibitor, polymer, 67 residues, 7448 Da.
Natural source: Common Name: lentil Taxonomy ID: 3864 Superkingdom: Eukaryota Kingdom: Viridiplantae Genus/species: Lens culinaris
Experimental source: Production method: Purified from the natural source
Entity Sequences (FASTA):
Bowman-Birk Inhibitor: GDDVKSACCDTCLCTRSQPP
TCRCVDVRESCHSACDKCVC
AYSNPPQCQCYDTHKFCYKA
CHNSEIE
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 417 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | LCTI monomer | 1 |
Entities:
Entity 1, LCTI monomer 67 residues - 7448 Da.
| 1 | GLY | ASP | ASP | VAL | LYS | SER | ALA | CYS | CYS | ASP | ||||
| 2 | THR | CYS | LEU | CYS | THR | ARG | SER | GLN | PRO | PRO | ||||
| 3 | THR | CYS | ARG | CYS | VAL | ASP | VAL | ARG | GLU | SER | ||||
| 4 | CYS | HIS | SER | ALA | CYS | ASP | LYS | CYS | VAL | CYS | ||||
| 5 | ALA | TYR | SER | ASN | PRO | PRO | GLN | CYS | GLN | CYS | ||||
| 6 | TYR | ASP | THR | HIS | LYS | PHE | CYS | TYR | LYS | ALA | ||||
| 7 | CYS | HIS | ASN | SER | GLU | ILE | GLU |
Samples:
sample_1: Bowman-Birk Inhibitor 1 ± 0.1 mM; D2O 10%; H2O 90%
sample_2: Bowman-Birk Inhibitor 1 ± 0.1 mM; D2O 100%
conditions_1: ionic strength: 3 mM; pH: 3.1; temperature: 298 K
conditions_2: ionic strength: 3.0 mM; pH*: 3.1; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| NOESY | sample_1 | not available | conditions_1 |
| TOCSY | sample_1 | not available | conditions_1 |
| COSY-DQF | sample_1 | not available | conditions_2 |
Software:
xwinnmr v2.6, Bruker Spectrospin - acquisition and processing
SPARKY v3.106, UCSF - assignment and cross-peak integration
NMR spectrometers:
- Bruker Spectrospin AMX-600 600 MHz