2XMJ

Visualising the Metal-binding Versatility of Copper Trafficking Sites: Atx1 side-to-side (aerobic)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-2
Synchrotron site	ESRF
Beamline	ID14-2
Temperature [K]	100
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	C 1 2 1
Unit cell lengths	63.460, 41.654, 55.832
Unit cell angles	90.00, 107.70, 90.00

Refinement procedure

Resolution	10.000 - 1.080
R-free	0.14880
Structure solution method	AB INITIO PHASING
Starting model (for MR)	NONE
RMSD bond length	0.014
RMSD bond angle	0.032
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	ACORN
Refinement software	SHELX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	13.810	1.140
High resolution limit [Å]	1.080	1.080
Rmerge	0.060	0.230
Number of reflections	56359
<I/σ(I)>	17.9	4.4
Completeness [%]	95.9	92.8
Redundancy	6.4	6.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.5		25 % (W/V) PEG 8000, 200 MM SODIUM ACETATE, 100 MM SODIUM CACODYLATE PH 6.5