8K2P

Crystal structure of CtGST-F76A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-03-17
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0
Spacegroup name	I 21 21 21
Unit cell lengths	80.481, 133.562, 143.386
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.580 - 2.200
R-factor	0.2052
Rwork	0.203
R-free	0.24730
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond angle	6.099
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.780	2.310
High resolution limit [Å]	2.200	2.200
Rmerge	0.093	1.098
Rmeas	0.097	0.097
Rpim	0.027	0.320
Total number of observations	490916
Number of reflections	37444	4096
<I/σ(I)>	18.7
Completeness [%]	94.0
Redundancy	13.1	12.5
CC(1/2)	0.999	0.868

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	1.5 M Lithium sulfate, 0.1 M Trisodium citrate, pH 6.0