6W9O

Crystal structure of an OTU deubiquitinase from Wolbachia pipientis wMel

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-06-28
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.96862
Spacegroup name	P 21 21 21
Unit cell lengths	52.543, 56.641, 63.956
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	33.000 - 1.470
R-factor	0.1646
Rwork	0.163
R-free	0.18980
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3c0r
Data reduction software	XDS (Jan 10, 2014)
Data scaling software	Aimless (0.3.6)
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	33.000	33.000	1.500
High resolution limit [Å]	1.470	8.050	1.470
Rmerge	0.053	0.024	0.754
Rmeas	0.061	0.028	0.866
Rpim	0.028	0.014	0.419
Total number of observations	141445	925	6619
Number of reflections	33057	241	1626
<I/σ(I)>	15.4	49.3	2.7
Completeness [%]	99.7	98.4	99.9
Redundancy	4.3	3.8	4.1
CC(1/2)	0.999	0.999	0.785

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2 M sodium acetate, 32% PEG 4K, 0.1 M Tris pH 8.5