4N5X

Crystal structure of N-terminal calmodulin-like Calcium sensor of human mitochondrial ATP-Mg/Pi carrier SCaMC1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER AXS MICROSTAR
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2012-05-04
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 31 2 1
Unit cell lengths	51.210, 51.210, 112.153
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.072 - 2.100
R-factor	0.1818
Rwork	0.177
R-free	0.22530
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1cll
RMSD bond length	0.007
RMSD bond angle	1.151
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8_1069))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	20.000	20.000	2.170
High resolution limit [Å]	2.100	4.510	2.100
Number of reflections	10443
Completeness [%]	99.7	100	99.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	9.1	298	100 mM CHES (pH 9.1) and 20% PEG3350, VAPOR DIFFUSION, HANGING DROP, temperature 298K