BMRB Entry 17828
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                PDB ID: 
                
                
                Entry in NMR Restraints Grid
                Validation report in NRG-CING
            Chem Shift validation:  AVS_full, LACS, SPARTA
BMRB Entry DOI: doi:10.13018/BMR17828
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Title: Ubiquitin-like domain from HOIL-1 PubMed: 22517668
Deposition date: 2011-08-03 Original release date: 2012-04-30
Authors: Beasley, Steven; Shaw, Gary; Beasley, Steven
Citation: Beasley, Steven; Safadi, Susan; Barber, Kathryn; Shaw, Gary. "Solution structure of the E3 ligase HOIL-1 Ubl domain." Protein Sci. 21, 1085-1092 (2012).
Assembly members:
HOIL-1_Ubl, polymer, 90 residues,   10353.854 Da.
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: recombinant technology Host organism: Escherichia coli
Entity Sequences (FASTA):
HOIL-1_Ubl: MPTQDIRLWVSVEDAQMHTV
TIWLTVRPDMTVASLKDMVF
LDYGFPPVLQQWVIGQRLAR
DQETLHSHGVRQNGDSAYLY
LLSARNTSLN
- assigned_chemical_shifts
 
| Data type | Count | 
| 13C chemical shifts | 391 | 
| 15N chemical shifts | 90 | 
| 1H chemical shifts | 633 | 
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID | 
|---|---|---|
| 1 | HOIL-1_Ubl | 1 | 
Entities:
Entity 1, HOIL-1_Ubl 90 residues - 10353.854 Da.
| 1 | MET | PRO | THR | GLN | ASP | ILE | ARG | LEU | TRP | VAL | |
| 2 | SER | VAL | GLU | ASP | ALA | GLN | MET | HIS | THR | VAL | |
| 3 | THR | ILE | TRP | LEU | THR | VAL | ARG | PRO | ASP | MET | |
| 4 | THR | VAL | ALA | SER | LEU | LYS | ASP | MET | VAL | PHE | |
| 5 | LEU | ASP | TYR | GLY | PHE | PRO | PRO | VAL | LEU | GLN | |
| 6 | GLN | TRP | VAL | ILE | GLY | GLN | ARG | LEU | ALA | ARG | |
| 7 | ASP | GLN | GLU | THR | LEU | HIS | SER | HIS | GLY | VAL | |
| 8 | ARG | GLN | ASN | GLY | ASP | SER | ALA | TYR | LEU | TYR | |
| 9 | LEU | LEU | SER | ALA | ARG | ASN | THR | SER | LEU | ASN | 
Samples:
sample_1: HOIL-1 Ubl, [U-15N], 0.2 mM; potassium phosphate 10 mM; EDTA 1 mM; potassium chloride 50 mM; DSS 30 uM; H2O 90%; D2O 10%
sample_2: HOIL-1 Ubl, [U-13C; U-15N], 0.2 mM; potassium phosphate 10 mM; EDTA 1 mM; potassium chloride 50 mM; DSS 30 uM; H2O 90%; D2O 10%
sample_3: HOIL-1 Ubl, [U-13C; U-15N], 0.2 mM; potassium phosphate 10 mM; EDTA 1 mM; potassium chloride 50 mM; DSS 30 uM; D2O 100%
sample_conditions_1: ionic strength: 61 mM; pH: 7.0; pressure: 1 atm; temperature: 298 K
Experiments:
| Name | Sample | Sample state | Sample conditions | 
|---|---|---|---|
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 | 
| 3D HNCO | sample_2 | isotropic | sample_conditions_1 | 
| 3D HN(CA)CO | sample_2 | isotropic | sample_conditions_1 | 
| 3D HNCA | sample_2 | isotropic | sample_conditions_1 | 
| 3D HN(CO)CA | sample_2 | isotropic | sample_conditions_1 | 
| 3D HNCACB | sample_2 | isotropic | sample_conditions_1 | 
| 3D CBCA(CO)NH | sample_2 | isotropic | sample_conditions_1 | 
| 3D C(CO)NH | sample_2 | isotropic | sample_conditions_1 | 
| 3D H(CCO)NH | sample_2 | isotropic | sample_conditions_1 | 
| 3D HCCH-TOCSY | sample_3 | isotropic | sample_conditions_1 | 
| 3D HCCH-COSY aromatic | sample_3 | isotropic | sample_conditions_1 | 
| 2D 1H-13C HSQC aromatic | sample_3 | isotropic | sample_conditions_1 | 
| 2D 1H-13C HSQC aliphatic | sample_3 | isotropic | sample_conditions_1 | 
| 3D 1H-13C NOESY aliphatic | sample_3 | isotropic | sample_conditions_1 | 
| 3D 1H-13C NOESY aromatic | sample_3 | isotropic | sample_conditions_1 | 
| 3D 1H-15N NOESY | sample_1 | isotropic | sample_conditions_1 | 
Software:
NMRPipe v5.0, Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax - processing
NMRDraw v5.0, Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax - processing
CYANA v2.1, Guntert, Mumenthaler and Wuthrich - structure solution
X-PLOR NIH v2.11.0, Schwieters, Kuszewski, Tjandra and Clore - refinement
TALOS vtalosplus, Cornilescu, Delaglio and Bax - geometry optimization
NMRView v8.0.rc47, Johnson, One Moon Scientific - chemical shift assignment, data analysis, peak picking
Procheck, Laskowski, MacArthur, Smith, Jones, Hutchinson, Morris, Moss and Tho - structure verification
VNMRJ v2.1B, Varian - collection
NMR spectrometers:
- Varian INOVA 600 MHz
 
Related Database Links:
| BMRB | 17959 | 
| PDB | |
| DBJ | BAC75409 BAG59927 BAG64417 | 
| GB | AAD00162 AAH15219 AIC59659 EAX10673 EAX10675 | 
| REF | NP_001253226 NP_006453 NP_112506 XP_001152050 XP_002747461 | 
| SP | Q9BYM8 | 
Download simulated HSQC data in one of the following formats:
            
CSV: Backbone
            or all simulated shifts
            
SPARKY: Backbone
            or all simulated shifts