5JK0

Crystal structure of XerH site-specific recombinase bound to difH substrate: pre-cleavage complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-12-03
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.92819
Spacegroup name	P 21 21 21
Unit cell lengths	79.280, 153.200, 169.390
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.890 - 2.100
R-factor	0.1928
Rwork	0.191
R-free	0.22330
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5jjv
RMSD bond length	0.003
RMSD bond angle	0.533
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.890	2.180
High resolution limit [Å]	2.100	2.100
Number of reflections	120659
<I/σ(I)>	12.53	2.25
Completeness [%]	99.9	99.81
Redundancy	6.6	6
CC(1/2)	0.998

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		279.15	0.2M sodium chloride, 21% PEG 3350