3O7R

Crystal structure of Ru(p-cymene)/apo-H49AFr

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL38B1
Synchrotron site	SPring-8
Beamline	BL38B1
Temperature [K]	100
Detector technology	CCD
Collection date	2010-02-11
Detector	RIGAKU JUPITER 210
Wavelength(s)	1.0
Spacegroup name	F 4 3 2
Unit cell lengths	181.703, 181.703, 181.703
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.280 - 1.900
R-factor	0.1956
Rwork	0.193
R-free	0.23730
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.017
RMSD bond angle	1.498
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall
Low resolution limit [Å]	30.000
High resolution limit [Å]	1.900
Number of reflections	20743

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	293	AMMONIUM SULFATE, CADMIUM SLFATE, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K