6YVG

Crystal structure of MesI (Lpg2505) from Legionella pneumophila

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-05-30
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.98
Spacegroup name	P 1 21 1
Unit cell lengths	38.960, 56.910, 70.920
Unit cell angles	90.00, 99.61, 90.00

Refinement procedure

Resolution	44.140 - 2.200
R-factor	0.1872
Rwork	0.185
R-free	0.23040
Structure solution method	SAD
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	CRANK2
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	44.140	44.140	2.300
High resolution limit [Å]	2.200	20.000	2.200
Rmerge	0.069	0.045	0.960
Rmeas	0.082	0.055	1.132
Total number of observations	107228
Number of reflections	15667	35	3770
<I/σ(I)>	9.74	24.09	1.25
Completeness [%]	99.6	85.4	98.3
Redundancy	3.529	2.686	3.523
CC(1/2)	0.998	0.994	0.622

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	200 mM ammonium iodide, 20 % w/v PEG3350
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	200 mM ammonium iodide, 20 % w/v PEG3350
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	200 mM ammonium iodide, 20 % w/v PEG3350