6UNW

Epoxide hydrolase from an endophytic Streptomyces

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	LNLS BEAMLINE W01B-MX2
Synchrotron site	LNLS
Beamline	W01B-MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-10-25
Detector	DECTRIS PILATUS 2M
Wavelength(s)	1.45
Spacegroup name	P 41 2 2
Unit cell lengths	106.733, 106.733, 233.039
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.520 - 2.210
R-factor	0.1887
Rwork	0.187
R-free	0.22720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2e3j
Data reduction software	XDS
Data scaling software	Aimless (0.2.8)
Phasing software	PHASER
Refinement software	PHENIX (18.1-3865)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.520	48.520	2.260
High resolution limit [Å]	2.210	10.370	2.210
Rmerge	0.120	0.035	1.242
Rmeas	0.124	0.037	1.297
Rpim	0.030	0.009	0.365
Total number of observations	1184544	11154	50856
Number of reflections	67798	786	4280
<I/σ(I)>	21.2	54.3	2.1
Completeness [%]	99.5	98.6	95
Redundancy	17.5	14.2	11.9
CC(1/2)	0.999	0.999	0.706

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	Tris-citrate