7TB5

Structure of P. aeruginosa PA17 CapW

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-08-11
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9792
Spacegroup name	P 61 2 2
Unit cell lengths	87.657, 87.657, 199.699
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	60.430 - 2.300
R-factor	0.2241
Rwork	0.223
R-free	0.24810
Structure solution method	SAD
RMSD bond length	0.009
RMSD bond angle	0.873
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	99.850	2.380
High resolution limit [Å]	2.300	2.300
Rmerge	0.111	2.549
Rmeas	0.114	2.618
Number of reflections	21112	1990
<I/σ(I)>	19.9	1.6
Completeness [%]	99.9	98.9
Redundancy	19.1	19.1
CC(1/2)	1.000	0.897

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.27 M LiSO4, 1% PEG 400, and 0.1 M sodium acetate (pH 5.0)