BMRB Entry 19376
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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/BMR19376
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Title: Calmodulin, C-terminal domain, M144H mutant
Deposition date: 2013-07-18 Original release date: 2014-06-16
Authors: Moroz, Yurii; Wu, Yibing; van Nuland, Nicolaas; Korendovych, Ivan
Citation: Moroz, Yurii; Wu, Yibing; van Nuland, Nicolaas; Korendovych, Ivan. "Calmodulin, C-terminal domain, M144H mutant" Not known ., .-..
Assembly members:
Calmodulin, C-terminal domain, polymer, 75 residues, Formula weight is not available
CALCIUM ION, non-polymer, 40.078 Da.
Natural source: Common Name: Chicken Taxonomy ID: 9031 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Gallus gallus
Experimental source: Production method: recombinant technology Host organism: Escherichia coli
Entity Sequences (FASTA):
Calmodulin, C-terminal domain: SLMKDTDSEEEIREAFRVFD
KDGNGYISAAELRHVMTNLG
EKLTDEEVDEMIREADIDGD
GQVNYEEFVQHMTAK
- assigned_chemical_shifts
- spectral_peak_list
| Data type | Count |
| 13C chemical shifts | 319 |
| 15N chemical shifts | 78 |
| 1H chemical shifts | 512 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | Calmodulin, C-terminal domain | 1 |
| 2 | calcium ion | 2 |
Entities:
Entity 1, Calmodulin, C-terminal domain 75 residues - Formula weight is not available
| 1 | SER | LEU | MET | LYS | ASP | THR | ASP | SER | GLU | GLU | ||||
| 2 | GLU | ILE | ARG | GLU | ALA | PHE | ARG | VAL | PHE | ASP | ||||
| 3 | LYS | ASP | GLY | ASN | GLY | TYR | ILE | SER | ALA | ALA | ||||
| 4 | GLU | LEU | ARG | HIS | VAL | MET | THR | ASN | LEU | GLY | ||||
| 5 | GLU | LYS | LEU | THR | ASP | GLU | GLU | VAL | ASP | GLU | ||||
| 6 | MET | ILE | ARG | GLU | ALA | ASP | ILE | ASP | GLY | ASP | ||||
| 7 | GLY | GLN | VAL | ASN | TYR | GLU | GLU | PHE | VAL | GLN | ||||
| 8 | HIS | MET | THR | ALA | LYS |
Entity 2, calcium ion - Ca - 40.078 Da.
| 1 | CA |
Samples:
sample_1: Calmodulin, C-terminal domain, [U-100% 13C; U-100% 15N], 1.1 mM; sodium azide 0.01%; sodium chloride 100 mM; calcium chloride 10 mM; H2O 90%; D2O 10%
sample_conditions_1: ionic strength: 0.1 M; pH: 7; pressure: 1 atm; temperature: 303 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
| 2D 1H-13C HSQC | sample_1 | isotropic | sample_conditions_1 |
| 3D CBCA(CO)NH | sample_1 | isotropic | sample_conditions_1 |
| 3D HNCO | sample_1 | isotropic | sample_conditions_1 |
| 3D HBHA(CO)NH | sample_1 | isotropic | sample_conditions_1 |
| 3D 1H-13C NOESY | sample_1 | isotropic | sample_conditions_1 |
| 3D 1H-15N NOESY | sample_1 | isotropic | sample_conditions_1 |
| 3D HCCH-TOCSY | sample_1 | isotropic | sample_conditions_1 |
| 3D HN(CO)CACB | sample_1 | isotropic | sample_conditions_1 |
Software:
NMRPipe, Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax - processing
VNMR, Varian - collection
CYANA, Guntert, Mumenthaler and Wuthrich - structure solution
CNS, Brunger, Adams, Clore, Gros, Nilges and Read - refinement
X-PLOR NIH, Schwieters, Kuszewski, Tjandra and Clore - refinement
PSVS, Bhattacharya and Montelione - data analysis
CARA, Keller and Wuthrich - chemical shift assignment
NMR spectrometers:
- Varian Unity 600 MHz
Related Database Links:
| BMRB | 16994 17881 17981 17982 17983 18084 18323 25344 |
| PDB | |
| DBJ | BAC39089 BAF45809 BAI66109 BAI66110 BAI66111 |
| EMBL | CAB51566 |
| GB | AAH10730 AAO17827 AAQ14324 AAX61134 AAY87961 |
| REF | XP_001687795 XP_001869425 XP_007442524 XP_009577260 XP_010190430 |
Download simulated HSQC data in one of the following formats:
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or all simulated shifts
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or all simulated shifts