BMRB Entry 15185
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR15185
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Title: backbone and side chain methly order parameters and correlation times for calmodulin in complex with the eNOS peptide PubMed: 17637663
Deposition date: 2007-03-19 Original release date: 2007-03-19
Authors: Frederick, Kendra; Marlow, Michael; Valentine, Kathleen; Wand, Joshua
Citation: Frederick, Kendra; Marlow, Michael; Valentine, Kathleen; Wand, Joshua. "Conformational entropy in molecular recognition by proteins" Nature 448, 325-329 (2007).
Assembly members:
calmodulin, polymer, 148 residues, Formula weight is not available
eNOSp, polymer, 20 residues, Formula weight is not available
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: ADQLTEEQIAEFKEAFSLFD
KDGDGTITTKELGTVMRSLG
QNPTEAELQDMINEVDADGN
GTIDFPEFLTMMARKMKDTD
SEEEIREAFRVFDKDGNGYI
SAAELRHVMTNLGEKLTDEE
VDEMIREADIDGDGQVNYEE
FVQMMTAK
eNOSp: RKKTFKEVANAVKISASLMG
- assigned_chemical_shifts
- order_parameters
Data type | Count |
order parameters | 195 |
Additional metadata:
Assembly:
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | calmodulin | 1 |
2 | eNOSp | 2 |
Entities:
Entity 1, calmodulin 148 residues - Formula weight is not available
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 |
Entity 2, eNOSp 20 residues - Formula weight is not available
derived from the CaM binding region of the human endothelial nitric oxide synthase
1 | ARG | LYS | LYS | THR | PHE | LYS | GLU | VAL | ALA | ASN | |
2 | ALA | VAL | LYS | ILE | SER | ALA | SER | LEU | MET | GLY |
Samples:
sample_1: calmodulin, [U-100% 15N], 1 mM; eNOSp 1.2 ± 0.1 mM; potassium chloride 100 mM; imidazole 20 mM; CaCl2 6 mM; sodium azide 3 mM; H2O 95%; D2O 5%
sample_2: calmodulin, [U-100% 13C; U-100% 15N; 55% 2H], 1 mM; eNOSp 1.2 ± 0.1 mM; potassium chloride 100 mM; imidazole 20 mM; CaCl2 6 mM; sodium azide 3 mM; H2O 95%; D2O 5%
sample_conditions_1: pH: 6.5; pressure: 1 atm; temperature: 308 K
Experiments:
Name | Sample | Sample state | Sample conditions |
---|---|---|---|
2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
2D 1H-13C HSQC | sample_2 | isotropic | sample_conditions_1 |
2D 1H-13C HSQC | sample_2 | isotropic | sample_conditions_1 |
Software:
FELIX, Accelrys Software Inc. - processing
NMR spectrometers:
- Varian INOVA 500 MHz
- Varian INOVA 600 MHz
Related Database Links:
BMRB | 15184 15186 15187 15188 15191 15470 15624 15650 15852 1634 16418 16465 1648 16764 17264 17360 17771 17807 18027 18028 18556 19036 19238 19586 19604 25253 25257 26503 26626 26627 4056 4270 4284 4310 18028 19586 |
PDB | |
DBJ | BAA08302 BAA11896 BAA19786 BAA19787 BAA19788 BAA05652 BAD15356 BAD97356 BAF85617 BAG37648 |
EMBL | CAA10601 CAA32050 CAA32062 CAA32119 CAA32120 CAA09493 CAA53950 CAI10801 |
GB | AAA35635 AAA35641 AAA37365 AAA40862 AAA40863 AAA30494 AAA30667 AAA30669 AAA36364 AAA36365 |
PIR | JC1305 MCON |
PRF | 0409298A 0608335A 2011304A |
REF | NP_001008160 NP_001009759 NP_001027633 NP_001039714 NP_001040234 NP_000594 NP_001003158 NP_001076202 NP_001123373 NP_001153581 |
SP | O02367 O16305 O96081 P02594 P05932 P29473 P29474 P70313 Q62600 Q9TUX8 |
TPG | DAA13808 DAA18029 DAA19590 DAA24777 DAA24988 DAA30266 |