4XI1

Crystal structure of U-box 2 of LubX / LegU2 / Lpp2887 from Legionella pneumophila str. Paris, wild-type

Replaces:  4WZ1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2012-12-07
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9790433
Spacegroup name	P 4 3 2
Unit cell lengths	160.227, 160.227, 160.227
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.874 - 2.983
R-factor	0.1647
Rwork	0.162
R-free	0.20950
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4wz2
RMSD bond length	0.009
RMSD bond angle	1.052
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	3.030
High resolution limit [Å]	2.980	2.980
Rmerge	0.080	0.623
Number of reflections	13171
<I/σ(I)>	23.58	2.7
Completeness [%]	88.7	92.7
Redundancy	5.7	5.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	298	15 mg/ml protein, V8 protease (1:100), 1.6 M ammonium sulfate, 0.1 M HEPES pH 7.5 and 2% hexanediol
1	VAPOR DIFFUSION, HANGING DROP	7.5	298	15 mg/ml protein, V8 protease (1:100), 1.6 M ammonium sulfate, 0.1 M HEPES pH 7.5 and 2% hexanediol