9RK4

Soluble domain of kuste4569, a Rieske iron-sulfur cluster protein from Kuenenia stuttgartiensis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-09-01
Detector	PSI JUNGFRAU 16M
Wavelength(s)	0.8856
Spacegroup name	P 21 21 21
Unit cell lengths	103.961, 120.730, 209.245
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	73.740 - 2.800
R-factor	0.2661
Rwork	0.265
R-free	0.29720
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.515
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	105.000	2.900
High resolution limit [Å]	2.800	2.800
Number of reflections	65436	6430
<I/σ(I)>	13
Completeness [%]	99.9
Redundancy	13.4
CC(1/2)	0.999	0.803

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	4% (v/v) 2,2,2-trifluoroethanol, 2 M ammonium sulfate