5E9F

Structural insights of isocitrate lyases from Magnaporthe oryzae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-10-01
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	0.964
Spacegroup name	P 21 21 21
Unit cell lengths	121.583, 135.314, 158.880
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.400 - 2.800
R-factor	0.187
Rwork	0.186
R-free	0.22600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1dqu
RMSD bond length	0.009
RMSD bond angle	1.143
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.900
High resolution limit [Å]	2.800	2.800
Number of reflections	64146
<I/σ(I)>	11.18
Completeness [%]	99.5
Redundancy	7.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	295	0.2M SODIUM MALONATE, 20% PEG 3350, 10% (V/V) GLYCEROL, PH 8.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 295.0K