8FI1

Structure of Lettuce C20G bound to DFHO

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-C
Synchrotron site	APS
Beamline	24-ID-C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-06-24
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	1.105
Spacegroup name	P 21 21 21
Unit cell lengths	25.815, 46.994, 120.981
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.810 - 2.600
R-factor	0.2241
Rwork	0.219
R-free	0.27100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8fhv
RMSD bond length	0.005
RMSD bond angle	0.768
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	120.980	2.430
High resolution limit [Å]	2.350	2.350
Rmerge	0.154	2.191
Number of reflections	6632	611
<I/σ(I)>	9.6	0.9
Completeness [%]	99.9
Redundancy	12.3
CC(1/2)	0.985	0.496

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	294	0.05 M Magnesium chloride hexahydrate, 0.1 M HEPES pH 7.5, 30% (v/v) polyethylene glycol monoethyl ether 550