5X9G

Crystal structure of the cytosolic domain of the Mg2+ channel MgtE in complex with ATP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL41XU
Synchrotron site	SPring-8
Beamline	BL41XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-10-13
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9791
Spacegroup name	P 21 21 21
Unit cell lengths	138.317, 106.672, 90.170
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.798 - 3.000
R-factor	0.2432
Rwork	0.240
R-free	0.29770
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.559
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	48.800
High resolution limit [Å]	2.990
Number of reflections	26821
<I/σ(I)>	10.7
Completeness [%]	97.5
Redundancy	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	7.4	293	20-22% PEG 400, 0.2 M MgCl2, and 0.1 M HEPES, pH 7.4, 10 mM ATP.