BMRB Entry 4642
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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/BMR4642
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Title: SOLUTION STRUCTURE OF HUMAN BETA-DEFENSIN-2 PubMed: 11300761
Deposition date: 2000-09-06 Original release date: 2001-05-07
Authors: Sawai, M.; Jia, H.; Liu, L.; Aseyev, V.; Wiencek, J.; McCray, P.; Ganz, T.; Kearney, W.; Tack, B.
Citation: Sawai, M.; Jia, H.; Liu, L.; Aseyev, V.; Wiencek, J.; McCray, P.; Ganz, T.; Kearney, W.; Tack, B.. "The NMR Structure of Human Beta-Defensin-2 Reveals a Novel Alpha-Helical Segment" Biochemistry 40, 3810-3816 (2001).
Assembly members:
HUMAN BETA-DEFENSIN-2, polymer, 41 residues, Formula weight is not available
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: .
Entity Sequences (FASTA):
HUMAN BETA-DEFENSIN-2: GIGDPVTCLKSGAICHPVFC
PRRYKQIGTCGLPGTKCCKK
P
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 285 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | BETA-DEFENSIN-2 | 1 |
Entities:
Entity 1, BETA-DEFENSIN-2 41 residues - Formula weight is not available
| 1 | GLY | ILE | GLY | ASP | PRO | VAL | THR | CYS | LEU | LYS | ||||
| 2 | SER | GLY | ALA | ILE | CYS | HIS | PRO | VAL | PHE | CYS | ||||
| 3 | PRO | ARG | ARG | TYR | LYS | GLN | ILE | GLY | THR | CYS | ||||
| 4 | GLY | LEU | PRO | GLY | THR | LYS | CYS | CYS | LYS | LYS | ||||
| 5 | PRO |
Samples:
sample_1: HUMAN BETA-DEFENSIN-2 0.87 mM; sodium phosphate buffer 45 mM; H2O 90%; D2O 10%
sample_cond_1: ionic strength: 0.045 M; pH: 3.74; pressure: 1.013 atm; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D NOESY | sample_1 | not available | sample_cond_1 |
| DOF-COSY | sample_1 | not available | sample_cond_1 |
| TOCSY | sample_1 | not available | sample_cond_1 |
Software:
DYANA v1.5 - structure solution
NMR spectrometers:
- Varian INOVA 500 MHz