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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/BMR36363
MolProbity Validation Chart
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
All files associated with the entry
Citation: Isozumi, Noriyoshi; Masubuchi, Yuya; Imamura, Tomohiro; Mori, Masashi; Koga, Hironori; Ohki, Shinya. "Structure and antimicrobial activity of NCR169, a nodule-specific cysteine-rich peptide of Medicago truncatula." Sci. Rep. 11, 9923-9923 (2021).
PubMed: 33972675
Assembly members:
Nodule Cysteine-Rich (NCR) secreted peptide, polymer, 39 residues, 4630.519 Da.
Natural source: Common Name: barrel medic Taxonomy ID: 3880 Superkingdom: not available Kingdom: Viridiplantae Genus/species: Medicago truncatula
Experimental source: Production method: recombinant technology Host organism: Escherichia coli
Entity Sequences (FASTA):
Nodule Cysteine-Rich (NCR) secreted peptide: GEDIGHIKYCGIVDDCYKSK
KPLFKIWKCVENVCVLWYK
| Data type | Count |
| 1H chemical shifts | 293 |
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | entity_1 | 1 |
Entity 1, entity_1 39 residues - 4630.519 Da.
| 1 | GLY | GLU | ASP | ILE | GLY | HIS | ILE | LYS | TYR | CYS | ||||
| 2 | GLY | ILE | VAL | ASP | ASP | CYS | TYR | LYS | SER | LYS | ||||
| 3 | LYS | PRO | LEU | PHE | LYS | ILE | TRP | LYS | CYS | VAL | ||||
| 4 | GLU | ASN | VAL | CYS | VAL | LEU | TRP | TYR | LYS |
sample_1: peptide 0.6 mM; H2O 90%; D2O, [U-2H], 10%
sample_2: peptide, [U-99% 15N], 0.3 mM; H2O 90%; D2O, [U-2H], 10%
sample_conditions_1: ionic strength: 0 mM; pH: 2.2; pressure: 1 atm; temperature: 298 K
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-1H TOCSY | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-1H NOESY | sample_1 | isotropic | sample_conditions_1 |
| 3D 1H-15N TOCSY | sample_2 | isotropic | sample_conditions_1 |
| 3D 1H-15N NOESY | sample_2 | isotropic | sample_conditions_1 |
CYANA, Guntert P. - refinement