5YPX

Crystal structure of calaxin with magnesium

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	95
Detector technology	CCD
Collection date	2015-10-31
Detector	ADSC QUANTUM 270
Wavelength(s)	1.0
Spacegroup name	P 43
Unit cell lengths	65.258, 65.258, 113.203
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.760 - 2.640
R-factor	0.16519
Rwork	0.163
R-free	0.21185
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.761
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall
Low resolution limit [Å]	46.100
High resolution limit [Å]	2.640
Number of reflections	14030
<I/σ(I)>	17.2
Completeness [%]	100.0
Redundancy	7.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.3	293	magnesium chloride, ammonium sulfate, PEG 5000 MME, barium chloride