BMRB Entry 5227
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5227
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Citation: Kranz, James; Flynn, Peter; Fuentes, Ernesto; Wand, A.. "Dissection of the Pathway of Molecular Recognition by Calmodulin" Biochemistry 41, 2599-2608 (2002).
PubMed: 11851407
Assembly members:
Calmodulin recognition element from smooth muscle myosin light chain kinase, polymer, 21 residues, 2336 Da.
calmodulin (chicken), polymer, 148 residues, 16700 Da.
Natural source: Common Name: Chicken Taxonomy ID: 9031 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Gallus gallus
Experimental source: Production method: recombinant technology
Entity Sequences (FASTA):
Calmodulin recognition element from smooth muscle myosin light chain kinase: GSARRKWQKTGHAVRAIGRL
S
calmodulin (chicken): ADQLTEEQIAEFKEAFSLFD
KDGDGTITTKELGTVMRSLG
QNPTEAELQDMINEVDADGN
GTIDFPEFLTMMARKMKDTD
SEEEIREAFRVFDKDGNGYI
SAAELRHVMTNLGEKLTDEE
VDEMIREADIDGDGQVNYEE
FVQMMTAK
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 135 |
| 13C chemical shifts | 87 |
| 15N chemical shifts | 25 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | smMLCKp peptide | 1 |
| 2 | calmodulin | 2 |
Entities:
Entity 1, smMLCKp peptide 21 residues - 2336 Da.
| 1 | GLY | SER | ALA | ARG | ARG | LYS | TRP | GLN | LYS | THR | ||||
| 2 | GLY | HIS | ALA | VAL | ARG | ALA | ILE | GLY | ARG | LEU | ||||
| 3 | SER |
Entity 2, calmodulin 148 residues - 16700 Da.
| 1 | ALA | ASP | GLN | LEU | THR | GLU | GLU | GLN | ILE | ALA | ||||
| 2 | GLU | PHE | LYS | GLU | ALA | PHE | SER | LEU | PHE | ASP | ||||
| 3 | LYS | ASP | GLY | ASP | GLY | THR | ILE | THR | THR | LYS | ||||
| 4 | GLU | LEU | GLY | THR | VAL | MET | ARG | SER | LEU | GLY | ||||
| 5 | GLN | ASN | PRO | THR | GLU | ALA | GLU | LEU | GLN | ASP | ||||
| 6 | MET | ILE | ASN | GLU | VAL | ASP | ALA | ASP | GLY | ASN | ||||
| 7 | GLY | THR | ILE | ASP | PHE | PRO | GLU | PHE | LEU | THR | ||||
| 8 | MET | MET | ALA | ARG | LYS | MET | LYS | ASP | THR | ASP | ||||
| 9 | SER | GLU | GLU | GLU | ILE | ARG | GLU | ALA | PHE | ARG | ||||
| 10 | VAL | PHE | ASP | LYS | ASP | GLY | ASN | GLY | TYR | ILE | ||||
| 11 | SER | ALA | ALA | GLU | LEU | ARG | HIS | VAL | MET | THR | ||||
| 12 | ASN | LEU | GLY | GLU | LYS | LEU | THR | ASP | GLU | GLU | ||||
| 13 | VAL | ASP | GLU | MET | ILE | ARG | GLU | ALA | ASP | ILE | ||||
| 14 | ASP | GLY | ASP | GLY | GLN | VAL | ASN | TYR | GLU | GLU | ||||
| 15 | PHE | VAL | GLN | MET | MET | THR | ALA | LYS |
Samples:
sample_1: Calmodulin recognition element from smooth muscle myosin light chain kinase, [U-99% 13C; U-99% 15N], 2.00 mM; calmodulin (chicken) 2.25 mM; CaCl2 20 mM; KCl 100 mM; Bis-tris 20 mM; NaN3 0.02%; D2O 7%
Ex-cond_1: pH*: 6.0 na; temperature: 303 K; ionic strength: 0.16 M
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 1H-15N HSQC | not available | not available | not available |
| 1H-13C CT-HSQC | not available | not available | not available |
| CBCA(CO)NH | not available | not available | not available |
| HNCACB | not available | not available | not available |
| HNCO | not available | not available | not available |
| HN(CA)CO | not available | not available | not available |
| HBHACONH | not available | not available | not available |
| HCCHTOCSY | not available | not available | not available |
| CH3-filtered (1H13C13C) HCCHTOCSY | not available | not available | not available |
| CCC TOCSY NNH | not available | not available | not available |
Software:
FELIX v98.0 - processing, peak picking, assignments
NMR spectrometers:
- Varian INOVA 750 MHz
Related Database Links:
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks