BMRB Entry 25210
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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/BMR25210
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Title: Shotgun proteolysis: A practical application
Deposition date: 2014-09-09 Original release date: 2014-09-15
Authors: Allen, Mark; Bycroft, M.; Freund, S.; Christ, D.
Citation: Allen, Mark; Bycroft, M.; Freund, S.; Christ, D.. "Shotgun proteolysis: A practical application" To Be Published ., .-..
Assembly members:
PUTATIVE_MEMBRANE_PROTEIN_IGAA_HOMOLOG, polymer, 120 residues, 13419.934 Da.
Natural source: Common Name: E. 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):
PUTATIVE_MEMBRANE_PROTEIN_IGAA_HOMOLOG: MAFADAQTRKLTPEERSAVE
NYLESLTQVLQVPGPTGASA
APISLALNAESNNVMMLTHA
ITRYGISTDDPNKWRYYLDS
VEVHLPPFWEQYINDENTVE
LIHTDSLPLVISLNGHTLQE
- assigned_chemical_shifts
Data type | Count |
1H chemical shifts | 853 |
13C chemical shifts | 524 |
15N chemical shifts | 111 |
Additional metadata:
Assembly:
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | PUTATIVE MEMBRANE PROTEIN IGAA HOMOLOG | 1 |
Entities:
Entity 1, PUTATIVE MEMBRANE PROTEIN IGAA HOMOLOG 120 residues - 13419.934 Da.
1 | MET | ALA | PHE | ALA | ASP | ALA | GLN | THR | ARG | LYS | |
2 | LEU | THR | PRO | GLU | GLU | ARG | SER | ALA | VAL | GLU | |
3 | ASN | TYR | LEU | GLU | SER | LEU | THR | GLN | VAL | LEU | |
4 | GLN | VAL | PRO | GLY | PRO | THR | GLY | ALA | SER | ALA | |
5 | ALA | PRO | ILE | SER | LEU | ALA | LEU | ASN | ALA | GLU | |
6 | SER | ASN | ASN | VAL | MET | MET | LEU | THR | HIS | ALA | |
7 | ILE | THR | ARG | TYR | GLY | ILE | SER | THR | ASP | ASP | |
8 | PRO | ASN | LYS | TRP | ARG | TYR | TYR | LEU | ASP | SER | |
9 | VAL | GLU | VAL | HIS | LEU | PRO | PRO | PHE | TRP | GLU | |
10 | GLN | TYR | ILE | ASN | ASP | GLU | ASN | THR | VAL | GLU | |
11 | LEU | ILE | HIS | THR | ASP | SER | LEU | PRO | LEU | VAL | |
12 | ILE | SER | LEU | ASN | GLY | HIS | THR | LEU | GLN | GLU |
Samples:
sample_1: PUTATIVE MEMBRANE PROTEIN IGAA HOMOLOG, [U-13C; U-15N], 1.5 mM; potassium phosphate 20 mM; NaCl 100 mM
sample_conditions_1: ionic strength: 120.000 mM; pH: 6.500; pressure: 1 atm; temperature: 293.000 K
Experiments:
Name | Sample | Sample state | Sample conditions |
---|---|---|---|
1H-15N HSQC | sample_1 | solution | sample_conditions_1 |
1H-13C HSQC | sample_1 | solution | sample_conditions_1 |
HNCACB | sample_1 | solution | sample_conditions_1 |
CBCA(CO)NH | sample_1 | solution | sample_conditions_1 |
HNCO | sample_1 | solution | sample_conditions_1 |
HN(CA)CO | sample_1 | solution | sample_conditions_1 |
HNHB | sample_1 | solution | sample_conditions_1 |
1H-NOESY | sample_1 | solution | sample_conditions_1 |
1H-DQF-COSY | sample_1 | solution | sample_conditions_1 |
1H-TOCSY | sample_1 | solution | sample_conditions_1 |
Software:
Ansig vany, Kraulis - chemical shift assignment
AutoDep v4.3, PDBe - chemical shift assignment
CNS vany, Brunger, Adams, Clore, Gros, Nilges and Read - chemical shift assignment
NMR spectrometers:
- Bruker Avance 500 MHz
- Bruker Avance 600 MHz
- Bruker Avance 800 MHz
Related Database Links:
UNP | IGAA_ECOLI |
PDB | |
DBJ | BAB37663 BAE77893 BAG79184 BAI27656 BAI32826 |
EMBL | CAP77845 CAQ33719 CAR00337 CAR04998 CAR10194 |
GB | AAA58195 AAC76423 AAG58498 AAN44877 AAN82607 |
REF | NP_312267 NP_417857 NP_709170 WP_000104248 WP_000104249 |
SP | P45800 P58720 |
Download simulated HSQC data in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts