7FF0

Pseudomonas aeruginosa Virulence Factor Regulator with cAMP ligand and auranofin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-X
Temperature [K]	200
Detector technology	PIXEL
Collection date	2018-06-22
Detector	DECTRIS PILATUS3 R 300K-W
Wavelength(s)	1.54
Spacegroup name	C 1 2 1
Unit cell lengths	135.600, 49.643, 63.915
Unit cell angles	90.00, 100.37, 90.00

Refinement procedure

Resolution	42.120 - 2.600
R-factor	0.2085
Rwork	0.207
R-free	0.23910
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2oz6
RMSD bond length	0.012
RMSD bond angle	1.522
Data reduction software	HKL-3000
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.000	2.690
High resolution limit [Å]	2.600	2.600
Number of reflections	23447	1273
<I/σ(I)>	3.8
Completeness [%]	99.0
Redundancy	1.9
CC(1/2)	0.986	0.653

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	2.6M AMMONIUM SULPHATE, 0.1M BICINE