9C63

High resolution structure of cytidine deaminase T6S toxin from Pseudomonas syringae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-11-17
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	52.687, 73.485, 78.061
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.140 - 1.340
R-factor	0.1702
Rwork	0.169
R-free	0.19540
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond angle	13.047
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]	30.140	1.410
High resolution limit [Å]	1.335	1.335
Rmerge	0.051	0.796
Rmeas	0.057	0.916
Rpim	0.024	0.447
Number of reflections	59524	2976
<I/σ(I)>	12.8	1.3
Completeness [%]	93.8
Redundancy	5
CC(1/2)	0.999	0.602

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	1.8 M Sodium phosphate monobasic monohydrate, Potassium phosphate dibasic pH 8.2