2HN1

Crystal structure of a CorA soluble domain from A. fulgidus in complex with Co2+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X8C
Synchrotron site	NSLS
Beamline	X8C
Temperature [K]	100
Detector technology	CCD
Collection date	2005-09-24
Detector	ADSC QUANTUM 4
Wavelength(s)	1.1000
Spacegroup name	P 61 2 2
Unit cell lengths	101.216, 101.216, 142.724
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	20.000 - 2.900
R-factor	0.3031
Rwork	0.303
R-free	0.31700
Structure solution method	MAD
RMSD bond length	0.008
RMSD bond angle	1.140
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SOLVE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	100.000	3.000
High resolution limit [Å]	2.900	2.900
Rmerge	0.078	0.479
Number of reflections	9953
<I/σ(I)>	24.5
Completeness [%]	100.0	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.4	295	1.3 M ammonium sulfate, 10 mM CoCl2, 0.1 M HEPES pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 295K
1	VAPOR DIFFUSION, HANGING DROP	7.4	295	1.3 M ammonium sulfate, 10 mM CoCl2, 0.1 M HEPES pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 295K
1	VAPOR DIFFUSION, HANGING DROP	7.4	295	1.3 M ammonium sulfate, 10 mM CoCl2, 0.1 M HEPES pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 295K