4XAB

Crystal Structure of EvdO2 from Micromonospora carbonacea var. aurantiaca

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	CCD
Collection date	2011-10-07
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.078
Spacegroup name	P 21 21 21
Unit cell lengths	42.612, 65.803, 84.462
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.044 - 1.750
R-factor	0.1765
Rwork	0.174
R-free	0.20370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3obz
RMSD bond length	0.007
RMSD bond angle	1.057
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.810
High resolution limit [Å]	1.750	3.770	1.750
Rmerge	0.068	0.050	0.296
Total number of observations	89257
Number of reflections	24725
<I/σ(I)>	13.1
Completeness [%]	99.9	99.4	99.6
Redundancy	3.6	3.4	3.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	38% PEG8000, 100 mM imidazole, 250 mM NaCl