5OMJ

R2-like ligand-binding oxidase with aerobically reconstituted metal cofactor after photoconversion

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-05-30
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1.000
Spacegroup name	I 2 2 2
Unit cell lengths	55.625, 97.312, 127.984
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.656 - 2.005
R-factor	0.2054
Rwork	0.202
R-free	0.26370
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	4hr0
RMSD bond length	0.017
RMSD bond angle	1.187
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.130
High resolution limit [Å]	2.000	2.000
Rmerge	0.137	2.325
Number of reflections	23693	3747
<I/σ(I)>	11.37	0.77
Completeness [%]	99.8	98.9
Redundancy	6.6	6.6
CC(1/2)	0.998	0.323

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	295	27.5% (w/v) PEG1500, 0.1 M HEPES-Na pH 7.5