9RK3

Soluble domain of kustd1480, 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	2025-01-01
Detector	PSI JUNGFRAU 16M
Wavelength(s)	0.88560
Spacegroup name	P 21 21 21
Unit cell lengths	46.200, 76.150, 79.520
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.510 - 2.500
R-factor	0.2232
Rwork	0.221
R-free	0.27610
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.019
RMSD bond angle	1.526
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.850
High resolution limit [Å]	1.800	1.800
Rmerge	0.065
Number of reflections	25291	1871
<I/σ(I)>	8.2
Completeness [%]	1.0
Redundancy	3.4
CC(1/2)	0.998	0.909

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M CHES pH 9.5, 17% PEG 8000