BMRB Entry 6375
Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR6375
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Title: Full 1H, 13C, and 15N Chemical Shift Assignments for Escherichia coli TonB 151-239 PubMed: 15644214
Deposition date: 2004-11-01 Original release date: 2005-03-07
Authors: Peacock, R.
Citation: Sean, Peacock; Weljie, Aalim; Peter, Howard; Price, Feodor; Vogel, Hans. "The solution structure of the C-terminal domain of TonB and interation studies with TonB box peptides." J. Mol. Biol. 345, 1185-1197 (2005).
Assembly members:
TonB C-terminal domain, polymer, 89 residues, Formula weight is not available
Natural source: Common Name: Escherichia coli Taxonomy ID: 562 Superkingdom: Bacteria Kingdom: not available Genus/species: Escherichia coli
Experimental source: Production method: recombinant technology Host organism: Escherichia coli
Entity Sequences (FASTA):
TonB C-terminal domain: SGPRALSRNQPQYPARAQAL
RIEGQVKVKFDVTPDGRVDN
VQILSAKPANMFEREVKNAM
RRWRYEPGKPGSGIVVNILF
KINGTTEIQ
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 641 |
| 13C chemical shifts | 359 |
| 15N chemical shifts | 93 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | TonB C-terminal Domain monomer | 1 |
Entities:
Entity 1, TonB C-terminal Domain monomer 89 residues - Formula weight is not available
| 1 | SER | GLY | PRO | ARG | ALA | LEU | SER | ARG | ASN | GLN | ||||
| 2 | PRO | GLN | TYR | PRO | ALA | ARG | ALA | GLN | ALA | LEU | ||||
| 3 | ARG | ILE | GLU | GLY | GLN | VAL | LYS | VAL | LYS | PHE | ||||
| 4 | ASP | VAL | THR | PRO | ASP | GLY | ARG | VAL | ASP | ASN | ||||
| 5 | VAL | GLN | ILE | LEU | SER | ALA | LYS | PRO | ALA | ASN | ||||
| 6 | MET | PHE | GLU | ARG | GLU | VAL | LYS | ASN | ALA | MET | ||||
| 7 | ARG | ARG | TRP | ARG | TYR | GLU | PRO | GLY | LYS | PRO | ||||
| 8 | GLY | SER | GLY | ILE | VAL | VAL | ASN | ILE | LEU | PHE | ||||
| 9 | LYS | ILE | ASN | GLY | THR | THR | GLU | ILE | GLN |
Samples:
sample_1: TonB C-terminal domain, [U-95% 13C; U-95% 15N], 1.4 mM; Sodium Phosphate 100 mM; Sodium Azide 0.6 mM
conditions_1: pH: 7.00; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 1D Proton | not available | not available | not available |
| 2D Proton-Proton NOESY (H2O) | not available | not available | not available |
| 2D Proton-Proton TOCSY (D2O) | not available | not available | not available |
| 2D Proton-Proton NOESY (D2O) | not available | not available | not available |
| Steady State 15N Heteronuclear nOe | not available | not available | not available |
| T1 15N | not available | not available | not available |
| T2 15N | not available | not available | not available |
| 2D 1H-15N HSQC | not available | not available | not available |
| 2D 1H-13C HSQC | not available | not available | not available |
| HNCO | not available | not available | not available |
| HN(CA)CO | not available | not available | not available |
| HNCA | not available | not available | not available |
| HN(CO)CA | not available | not available | not available |
| CBCA(CO)NH | not available | not available | not available |
| CBCANH | not available | not available | not available |
| HCCH-TOCSY | not available | not available | not available |
| CCCONH-TOCSY | not available | not available | not available |
| HBHA(CO)NH | not available | not available | not available |
| HCCCONH-TOCSY | not available | not available | not available |
| 3D 13C separated NOESY | not available | not available | not available |
| 3D 15N separated NOESY | not available | not available | not available |
Software:
No software information available
NMR spectrometers:
- Bruker Avance 700 MHz
- Bruker Avance 500 MHz
Related Database Links:
| PDB | |
| DBJ | BAA14784 BAB35175 BAG66413 BAG76825 BAI25062 |
| EMBL | CAP75797 CAQ31753 CAQ98131 CAR02647 CAR07605 |
| GB | AAB59066 AAB60069 AAB60077 AAB60085 AAB60093 |
| REF | NP_287495 NP_309779 NP_415768 NP_707161 NP_753622 |
| SP | P02929 |
| AlphaFold | P02929 |
Download HSQC peak lists in one of the following formats:
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or all simulated shifts