1H33

Oxidised SoxAX complex from Rhodovulum sulfidophilum

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
Collection date	1999-12-15
Detector	MARRESEARCH
Spacegroup name	P 21 21 2
Unit cell lengths	66.353, 87.341, 71.654
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 1.750
R-factor	0.179
Rwork	0.179
R-free	0.21400 *
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.021
RMSD bond angle	1.671
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000
High resolution limit [Å]	1.750
Rmerge	0.070	0.168 *
Total number of observations	262534 *
Number of reflections	42647
Completeness [%]	93.4	91.4 *
Redundancy	10

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	6.5		pH 6.50

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	reservoir	PEG8000	15 (%(w/v))
2	1	reservoir	magnesium acetate	0.2 (M)
3	1	reservoir	MES	100 (mM)	pH6.5