5X90

Structure of DotL(656-783)-IcmS-IcmW-LvgA derived from Legionella pneumophila

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-04-27
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0000
Spacegroup name	P 32
Unit cell lengths	152.325, 152.325, 74.475
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	41.432 - 2.800
R-factor	0.2531
Rwork	0.252
R-free	0.29470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5x1e
RMSD bond length	0.006
RMSD bond angle	0.943
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.850
High resolution limit [Å]	2.800	7.590	2.800
Rmerge	0.081	0.044	0.370
Rmeas	0.091	0.049	0.452
Rpim	0.041	0.021	0.255
Total number of observations	194861
Number of reflections	46584
<I/σ(I)>	10.5
Completeness [%]	97.9	99.7	90.4
Redundancy	4.2	5.1	2.5
CC(1/2)		0.997	0.379

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	100mM Bis-Tris (pH 5.5), 15%(v/v) PEG3350, 8mM spermine tetrahydrochloride