BMRB Entry 4182
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full
BMRB Entry DOI: doi:10.13018/BMR4182
MolProbity Validation Chart
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NMR-STAR v3 text file.
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Citation: Bertini, Ivano; Kurtz, Donald; Eidsness, Marly; Liu, Gaohua; Luchinat, Claudio; Rosato, Antonio; Scott, Robert. "Solution Structure of Reduced Clostridium pasteurianum Rubredoxin" J. Biol. Inorg. Chem. 3, 401-410 (1998).
Assembly members:
reduced rubredoxin, polymer, 54 residues, Formula weight is not available
FE2, non-polymer, 55.845 Da.
Natural source: Common Name: clostridium pasteurianum Taxonomy ID: 1501 Superkingdom: Eubacteria Kingdom: not available Genus/species: clostridium pasteurianum
Experimental source: Production method: .
Entity Sequences (FASTA):
reduced rubredoxin: MKKYTCTVCGYIYNPEDGDP
DNGVNPGTDFKDIPDDWVCP
LCGVGKDQFEEVEE
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 285 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | cprd | 1 |
| 2 | Fe | 2 |
Entities:
Entity 1, cprd 54 residues - Formula weight is not available
| 1 | MET | LYS | LYS | TYR | THR | CYS | THR | VAL | CYS | GLY | ||||
| 2 | TYR | ILE | TYR | ASN | PRO | GLU | ASP | GLY | ASP | PRO | ||||
| 3 | ASP | ASN | GLY | VAL | ASN | PRO | GLY | THR | ASP | PHE | ||||
| 4 | LYS | ASP | ILE | PRO | ASP | ASP | TRP | VAL | CYS | PRO | ||||
| 5 | LEU | CYS | GLY | VAL | GLY | LYS | ASP | GLN | PHE | GLU | ||||
| 6 | GLU | VAL | GLU | GLU |
Entity 2, Fe - Fe - 55.845 Da.
| 1 | FE2 |
Samples:
sample_one: reduced rubredoxin3.5 – 4 mM
sample_conditions_one: ionic strength: 0.1 M; pH: 6.8; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| NOESY | sample_one | not available | sample_conditions_one |
| TOCSY | sample_one | not available | sample_conditions_one |
| DQF-COSY | sample_one | not available | sample_conditions_one |
| IR-NOESY | sample_one | not available | sample_conditions_one |
Software:
No software information available
NMR spectrometers:
- Brucker Avance 800 MHz
- Brucker AMX 600 MHz