5Y9O

The apo structure of Legionella pneumophila WipA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-04-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9785
Spacegroup name	P 21 21 2
Unit cell lengths	93.608, 95.976, 106.635
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.608 - 2.554
R-factor	0.226
Rwork	0.223
R-free	0.28210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5n6x
RMSD bond length	0.007
RMSD bond angle	0.875
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.640
High resolution limit [Å]	2.550	2.550
Rmerge	0.250	0.991
Number of reflections	31780	31604
<I/σ(I)>	16	2
Completeness [%]	100.0	100
Redundancy	12.5	11.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	298	14% PEG6000, 0.1 M MES (pH 6.0) and 0.1 M NaCl