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1H,15N and 13C assigned Chemical Shifts for a complex of calmodulin with a peptide of the olfactory CNGC channel
Authors
Orsale, M., Melino, S., Torre, V., Motta, A., Paci, M., Desideri, A., Cicero, D.
Assembly
Calmodulin-olfactory channel peptide complex
Entity
1. Calmodulin (polymer, Thiol state: not present), 148 monomers, 16706.21 Da Detail

ADQLTEEQIA EFKEAFSLFD KDGDGTITTK ELGTVMRSLG QNPTEAELQD MINEVDADGN GTIDFPEFLT MMARKMKDTD SEEEIREAFR VFDKDGNGYI SAAELRHVMT NLGEKLTDEE VDEMIREADI DGDGQVNYEE FVQMMTAK


2. olfactory channel peptide (polymer, Thiol state: not present), 26 monomers, 3261.751 Da Detail

QQRRGGFRRI ARLVGVLREW AYRNFR


3. CA (non-polymer), 40.078 × 4 Da
Total weight
20128.273 Da
Max. entity weight
16706.21 Da
Source organism
Xenopus laevis
Exptl. method
NMR
Refine. method
SIMULATED ANNEALING
Data set
assigned_chemical_shifts
Chem. Shift Complete1
Sequence coverage: 85.1 %, Completeness: 81.5 %, Completeness (bb): 84.3 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All81.5 % (1637 of 2008)81.1 % (851 of 1049)81.7 % (630 of 771)83.0 % (156 of 188)
Backbone84.3 % (877 of 1040)83.9 % (302 of 360)84.8 % (431 of 508)83.7 % (144 of 172)
Sidechain79.4 % (896 of 1128)79.7 % (549 of 689)79.2 % (335 of 423)75.0 % (12 of 16)
Aromatic59.3 % (83 of 140)64.3 % (45 of 70)55.1 % (38 of 69) 0.0 % (0 of 1)
Methyl84.9 % (141 of 166)85.5 % (71 of 83)84.3 % (70 of 83)

1. Calmodulin

ADQLTEEQIA EFKEAFSLFD KDGDGTITTK ELGTVMRSLG QNPTEAELQD MINEVDADGN GTIDFPEFLT MMARKMKDTD SEEEIREAFR VFDKDGNGYI SAAELRHVMT NLGEKLTDEE VDEMIREADI DGDGQVNYEE FVQMMTAK

2. olfactory channel peptide

QQRRGGFRRI ARLVGVLREW AYRNFR

Sample #1

Temperature 308 (±1) K, pH 6.7 (±0.1)


#NameIsotope labelingTypeConcentration
1Calmodulin[U-95% 13C; U-95% 15N]1.2 mM
2olfactory channel peptide1.2 mM
3KCl140 mM
4CaCl27 mM
Sample #2

Temperature 308 (±1) K, pH 6.7 (±0.1)


#NameIsotope labelingTypeConcentration
5Calmodulin[U-15N]0.4 mM
6olfactory channel peptide0.4 mM
7KCl140 mM
8CaCl27 mM

Chem. Shift Complete2
Sequence coverage: 42.0 %, Completeness: 52.9 %, Completeness (bb): 55.5 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All52.9 % (2124 of 4016)55.6 % (1166 of 2098)49.2 % (758 of 1542)53.2 % (200 of 376)
Backbone55.5 % (1155 of 2080)60.3 % (434 of 720)52.8 % (536 of 1016)53.8 % (185 of 344)
Sidechain50.6 % (1142 of 2256)53.1 % (732 of 1378)46.7 % (395 of 846)46.9 % (15 of 32)
Aromatic42.5 % (119 of 280)53.6 % (75 of 140)31.9 % (44 of 138) 0.0 % (0 of 2)
Methyl52.7 % (175 of 332)57.8 % (96 of 166)47.6 % (79 of 166)

1. Calmodulin

ADQLTEEQIA EFKEAFSLFD KDGDGTITTK ELGTVMRSLG QNPTEAELQD MINEVDADGN GTIDFPEFLT MMARKMKDTD SEEEIREAFR VFDKDGNGYI SAAELRHVMT NLGEKLTDEE VDEMIREADI DGDGQVNYEE FVQMMTAK

2. olfactory channel peptide

QQRRGGFRRI ARLVGVLREW AYRNFR

Sample #1

Temperature 308 (±1) K, pH 6.7 (±0.1)


#NameIsotope labelingTypeConcentration
1Calmodulin[U-95% 13C; U-95% 15N]1.2 mM
2olfactory channel peptide1.2 mM
3KCl140 mM
4CaCl27 mM
Sample #2

Temperature 308 (±1) K, pH 6.7 (±0.1)


#NameIsotope labelingTypeConcentration
5Calmodulin[U-15N]0.4 mM
6olfactory channel peptide0.4 mM
7KCl140 mM
8CaCl27 mM

Protein Blocks Logo
Calculated from 26 models in PDB: 1CFF, Strand ID: A Detail


Release date
2003-12-07
Citation 1
Two distinct calcium-calmodulin interactions with N-terminal regions of the olfactory and rod cyclic nucleotide-gated channels characterized by NMR spectroscopy
Orsale, M., Melino, S., Contessa, G.M., Torre, V., Andreotti, G., Motta, A., Paci, M., Desideri, A., Cicero, D.
FEBS Lett. (2003), 548, 11-16, PubMed 12885399 , DOI: ,
Citation 2
NMR solution structure of a complex of calmodulin with a binding peptide of the Ca2+ pump
Elshorst, B., Hennig, M., Forsterling, H., Diener, A., Maurer, M., Schulte, P., Schwalbe, H., Griesinger, C., Krebs, J., Schmid, H., Vorherr, T., Carafoli, E.
Biochemistry (1999), 38, 12320-12332, PubMed 10493800 , DOI: ,
Citation 3
Calcium-induced conformational transition revealed by the solution structure of apo calmodulin
Zhang, M., Tanaka, T., Ikura, M.
Nat. Struct. Biol. (1995), 2, 758-767, PubMed 7552747 , DOI: ,
Citation 4
Target enzyme recognition by calmodulin: 2.4 A structure of a calmodulin-peptide complex
Meador, W.E., Means, A.R., Quiocho, F.A.
Science (1992), 257, 1251-1255, PubMed 1519061 , DOI: ,
Citation 5
Solution structure of calcium-free calmodulin
Kuboniwa, H., Tjandra, N., Grzesiek, S., Ren, H., Klee, C.B., Bax, A.
Nat. Struct. Biol. (1995), 2, 768-776, PubMed 7552748 , DOI: ,
Citation 6
Drug binding by calmodulin: crystal structure of a calmodulin-trifluoperazine complex
Cook, W.J., Walter, L.J., Walter, M.R.
Biochemistry (1994), 33, 15259-15265, PubMed 7803388 , DOI: ,
Citation 7
Calmodulin structure refined at 1.7 A resolution
Chattopadhyaya, R., Meador, W.E., Means, A.R., Quiocho, F.A.
J. Mol. Biol. (1992), 228, 1177-1192, PubMed 1474585 ,
Citation 8
Trifluoperazine-induced conformational change in Ca(2+)-calmodulin
Vandonselaar, M., Hickie, R.A., Quail, J.W., Delbaere, L.T.
Nat. Struct. Biol. (1994), 1, 795-801, PubMed 7634090 , DOI: ,
Citation 9
Motions of calmodulin characterized using both Bragg and diffuse X-ray scattering
Wall, M.E., Clarage, J.B., Phillips, G.N.
Structure (1997), 5, 1599-1612, PubMed 9438860 , DOI: ,
Citation 10
Solution structure of calmodulin-W-7 complex: the basis of diversity in molecular recognition
Osawa, M., Swindells, M.B., Tanikawa, J., Tanaka, T., Mase, T., Furuya, T., Ikura, M.
J. Mol. Biol. (1998), 276, 165-176, PubMed 9514729 , DOI 10.1006/jmbi.1997.1524 ,
Citation 11
A novel target recognition revealed by calmodulin in complex with Ca2+-calmodulin-dependent kinase kinase
Osawa, M., Tokumitsu, H., Swindells, M.B., Kurihara, H., Orita, M., Shibanuma, T., Furuya, T., Ikura, M.
Nat. Struct. Biol. (1999), 6, 819-824, PubMed 10467092 , DOI 10.1038/12271 ,
Citation 12
NMRPipe: a multidimensional spectral processing system based on UNIX pipes
Delaglio, F., Grzesiek, S., Vuister, G.W., Zhu, G., Pfeifer, J., Bax, A.
J. Biomol. NMR (1995), 6, 277-293, PubMed 8520220 ,
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  Swiss-Prot: P97756 released on 2004-12-07
    Title KKCC1_RAT Entity Calcium/calmodulin-dependent protein kinase kinase 1
  Swiss-Prot: P23634 released on 1991-11-01
    Title AT2B4_HUMAN Entity Plasma membrane calcium-transporting ATPase 4
  Swiss-Prot: P62155 released on 1986-07-21
    Title CALM_XENLA Entity Calmodulin
  Swiss-Prot: P62157 released on 1986-07-21
    Title CALM_BOVIN Entity Calmodulin
  Swiss-Prot: P62158 released on 1986-07-21
    Title CALM_HUMAN Entity Calmodulin
Related entities 1. Calmodulin, : 11 : 88 entities Detail
Related entities 2. olfactory channel peptide, : 1 : 1 : 11 entities Detail
Interaction partners 2. olfactory channel peptide, : 1 interactors Detail
Experiments performed 13 experiments Detail
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