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BMRB: 15624

2JZI

Structure of Calmodulin complexed with the Calmodulin Binding Domain of Calcineurin

Authors

Chyan, C., Irene, D.

Assembly

CaMCaNp

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. Calmodulin binding domain of Calcineurin (polymer, Thiol state: not present), 24 monomers, 2812.431 Da Detail

ARKEVIRNKI RAIGKMARVF SVLR

3. CA (non-polymer), 40.078 Da

Total weight

19558.72 Da

Max. entity weight

16706.21 Da

Source organism

Exptl. method

Refine. method

distance geometry

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 92.4 %, Completeness (bb): 98.6 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	92.4 % (1824 of 1973)	93.5 % (962 of 1029)	90.8 % (691 of 761)	93.4 % (171 of 183)
Backbone	98.6 % (1014 of 1028)	98.9 % (350 of 354)	99.0 % (499 of 504)	97.1 % (165 of 170)
Sidechain	87.8 % (970 of 1105)	90.7 % (612 of 675)	84.4 % (352 of 417)	46.2 % (6 of 13)
Aromatic	41.8 % (46 of 110)	83.6 % (46 of 55)	0.0 % (0 of 55)
Methyl	97.7 % (172 of 176)	98.9 % (87 of 88)	96.6 % (85 of 88)

1. Calmodulin

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

2. Calmodulin binding domain of Calcineurin

ARKEVIRNKI RAIGKMARVF SVLR

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

Protein Blocks Logo

Calculated from 20 models in PDB: 2JZI, Strand ID: A, B Detail

Release date

2008-01-09

Citation

Structure of Calmodulin complexed with the Calmodulin Binding Domain of Calcineurin
Chyan, C., Irene, D.
Not known

Related entities 1. Calmodulin, : 11 : 88 entities Detail

Related entities 2. Calmodulin binding domain of Calcineurin, : 1 : 10 : 10 : 9 : 23 entities Detail

Interaction partners 2. Calmodulin binding domain of Calcineurin, : 1 interactors Detail

More details for 1 interactors identified by 1 citations

Experiments performed 16 experiments Detail

1 2D 1H-15N HSQC

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

2 2D 1H-13C HSQC

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

3 3D HNCA

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

4 3D HN(CO)CA

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

5 3D CBCA(CO)NH

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

6 3D CBCANH

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

7 3D C(CO)NH

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

8 3D HBHA(CO)NH

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

9 3D HNCO

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

10 3D HCCH TOCSY

Instrument

Bruker Avance - 800 MHz High Field Nuclear Magnetic Center, Academia Sinica, Taiwan

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

11 3D 1H-15N NOESY

Instrument

Bruker Avance - 800 MHz High Field Nuclear Magnetic Center, Academia Sinica, Taiwan

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

12 3D 1H-13C NOESY

Instrument

Bruker Avance - 800 MHz High Field Nuclear Magnetic Center, Academia Sinica, Taiwan

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

13 2D DQF-COSY

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

14 2D 1H-1H TOCSY

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

15 2D 1H-1H NOESY

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

16 3D H(CCO)NH

Instrument

Bruker Avance - 600 MHz National Dong Hwa University

Sample

State isotropic, Solvent system 90% H2O/10% D2O, Temperature 310 (±0.1) K, pH 6.5 (±0.05)

#	Name	Isotope labeling	Type	Concentration
1	Calmodulin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
2	Calmodulin binding domain of Calcineurin	[U-99% 13C; U-99% 15N]		1 (±0.05) mM
3	CALCIUM ION			1 (±0.05) mM

nullKeywords NMR, calcineurin, calmodulin, molecular interaction, Calcium binding protein