9C64

Cytidine deaminase T6S toxin from Pseudomonas syringae complexed with substrate DNA

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	2022-07-27
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.979
Spacegroup name	P 61
Unit cell lengths	87.919, 87.919, 134.482
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	66.260 - 1.940
R-factor	0.1627
Rwork	0.161
R-free	0.19020
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond angle	16.806
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.260	2.032
High resolution limit [Å]	1.940	1.942
Rmerge	0.152	1.702
Rmeas	0.164	1.832
Rpim	0.061	0.674
Total number of observations		14248
Number of reflections	39004	1950
<I/σ(I)>	7.7	1.5
Completeness [%]	89.7
Redundancy	7.1	7.3
CC(1/2)	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	0.15M Ammonium Chloride, 22.5% PEG3350