7JOF

Calcium-bound C2A Domain from Human Dysferlin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Temperature [K]	100
Detector technology	CCD
Collection date	2017-02-05
Detector	RIGAKU SATURN 944+
Wavelength(s)	1.5
Spacegroup name	P 1
Unit cell lengths	45.520, 54.780, 57.340
Unit cell angles	116.80, 103.47, 92.92

Refinement procedure

Resolution	9.986 - 2.000
R-factor	0.2415
Rwork	0.241
R-free	0.24870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ihb
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	23.720	23.720	2.040
High resolution limit [Å]	1.990	8.910	1.990
Rmerge	0.061	0.042	0.155
Rmeas	0.086	0.059	0.219
Rpim	0.061	0.042	0.155
Total number of observations	47404	540	2369
Number of reflections	28309	288	1441
<I/σ(I)>	9	18.9	4.5
Completeness [%]	87.6	79.3	60.6
Redundancy	1.7	1.9	1.6
CC(1/2)	0.992	0.980	0.917

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	283.15	0.2 mM magnesium chloride hexahydrate, 0.1 M Tris hydrochloride, and 30% Polyethylene glycol 4,000 (commercial reagent kit from Hampton Research, HR2-130) at pH 8.5