9NX5

Crystal Structure of a P. Aeruginosa Gyrase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-05-19
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.977
Spacegroup name	P 63 2 2
Unit cell lengths	218.159, 218.159, 108.803
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	48.760 - 2.400
R-factor	0.2426
Rwork	0.242
R-free	0.25670
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.563
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.440
High resolution limit [Å]	2.400	2.400
Rmerge	0.099	1.259
Rmeas	0.102	1.307
Rpim	0.026	0.345
Number of reflections	59670	2934
<I/σ(I)>	5.8
Completeness [%]	100.0
Redundancy	15.7
CC(1/2)	0.994	0.785

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	277	.1M HEPES pH 7.5 26% MBP 5% PEG8K