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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR15257
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
Citation: Schubert, Mario; Lapouge, Karine; Duss, Olivier; Oberstrass, Florian; Jelesarov, Ilian; Haas, Dieter; Allain, Frederic. "Molecular basis of messenger RNA recognition by the specific bacterial repressing clamp RsmA/CsrA." Nat. Struct. Mol. Biol. 14, 807-813 (2007).
PubMed: 17704818
Assembly members:
hncA_mRNA_SD_20mer, polymer, 20 residues, 6437.938 Da.
RsmE, polymer, 70 residues, 5851.832 Da.
Natural source: Common Name: not available Taxonomy ID: 294 Superkingdom: Bacteria Kingdom: not available Genus/species: Pseudomonas fluorescens
Experimental source: Production method: in vitro transcription Host organism: Pseudomonas fluorescens Vector: not applicable
Entity Sequences (FASTA):
hncA_mRNA_SD_20mer: GGGCUUCACGGAUGAAGCCC
RsmE: MLILTRKVGESINIGDDITI
TILGVSGQQVRIGINAPKDV
AVHREEIYQRIQAGLTAPDK
RETPHHHHHH
Data type | Count |
13C chemical shifts | 340 |
15N chemical shifts | 77 |
1H chemical shifts | 625 |
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | 20 mer, 1 | 1 |
2 | 20 mer, 2 | 1 |
3 | RsmE A | 2 |
4 | RsmE B | 2 |
Entity 1, 20 mer, 1 20 residues - 6437.938 Da.
1 | G | G | G | C | U | U | C | A | C | G | |
2 | G | A | U | G | A | A | G | C | C | C |
Entity 2, RsmE A 70 residues - 5851.832 Da.
1 | MET | LEU | ILE | LEU | THR | ARG | LYS | VAL | GLY | GLU | |
2 | SER | ILE | ASN | ILE | GLY | ASP | ASP | ILE | THR | ILE | |
3 | THR | ILE | LEU | GLY | VAL | SER | GLY | GLN | GLN | VAL | |
4 | ARG | ILE | GLY | ILE | ASN | ALA | PRO | LYS | ASP | VAL | |
5 | ALA | VAL | HIS | ARG | GLU | GLU | ILE | TYR | GLN | ARG | |
6 | ILE | GLN | ALA | GLY | LEU | THR | ALA | PRO | ASP | LYS | |
7 | ARG | GLU | THR | PRO | HIS | HIS | HIS | HIS | HIS | HIS |
sample_1: RsmE, [U-100% 15N], 1 mM; hncA_mRNA_SD_20mer 1 mM; H2O 97%; D2O 3%; NaCl 30 mM; K2HPO4 50 mM
sample_2: RsmE, [U-100% 13C; U-100% 15N], 1 mM; hncA_mRNA_SD_20mer 1 mM; D2O 100%; NaCl 30 mM; K2HPO4 50 mM
sample_3: RsmE, [U-100% 13C; U-100% 15N], 1 mM; hncA_mRNA_SD_20mer 1 mM; H2O 97%; D2O 3%; NaCl 30 mM; K2HPO4 50 mM
sample_4: RsmE, [U-100% 15N], 1 mM; hncA_mRNA_SD_20mer 1 mM; D2O 100%; NaCl 30 mM; K2HPO4 50 mM
sample_conditions_1: ionic strength: 0.18 M; pH: 7.2; pressure: 1 atm; temperature: 313.15 K
Name | Sample | Sample state | Sample conditions |
---|---|---|---|
2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
3D 1H-15N NOESY | sample_1 | isotropic | sample_conditions_1 |
3D CBCA(CO)NH | sample_3 | isotropic | sample_conditions_1 |
3D HNCA | sample_3 | isotropic | sample_conditions_1 |
3D HNCACB | sample_3 | isotropic | sample_conditions_1 |
3D HNCO | sample_3 | isotropic | sample_conditions_1 |
2D 1H-1H TOCSY | sample_1 | isotropic | sample_conditions_1 |
3D H(CCO)NH | sample_3 | isotropic | sample_conditions_1 |
2D 1H-1H NOESY | sample_1 | isotropic | sample_conditions_1 |
2D 1H-13C HSQC | sample_2 | isotropic | sample_conditions_1 |
3D 1H-13C NOESY | sample_3 | isotropic | sample_conditions_1 |
3D HN(CO)CA | sample_3 | isotropic | sample_conditions_1 |
AMBER v7.0, Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Koll - refinement
DYANA v3.02, Guntert, Braun and Wuthrich - geometry optimization
SPARKY, Goddard - chemical shift assignment, data analysis
CCP4, CCP4 Executuve Committee - rename chains, superpose ensemble
BMRB | 19534 19544 19546 19547 19548 19549 |
PDB | |
DBJ | BAO61455 BAQ73744 BAQ80031 |
GB | AAT27429 AAY91370 AEL31265 AGL83913 AIC19187 |
REF | WP_007920550 WP_017337657 WP_045057924 WP_057444113 |
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks