8AVN

Mutant of Superoxide dismutase SodFM1 from CPR Parcubacteria Wolfebacteria

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-02-26
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.99987
Spacegroup name	P 1 21 1
Unit cell lengths	46.490, 69.710, 58.010
Unit cell angles	90.00, 100.24, 90.00

Refinement procedure

Resolution	45.790 - 1.650
Rwork	0.152
R-free	0.22000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1gv3
RMSD bond length	0.011
RMSD bond angle	1.659
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0415)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.790	1.680
High resolution limit [Å]	1.650	1.650
Number of reflections	43267	2095
<I/σ(I)>	6.5	1.4
Completeness [%]	98.7
Redundancy	6.5
CC(1/2)	0.999	0.556

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	200 mM sodium chloride, 100 mM sodium acetate pH 5.0 and 20 % w/v polyethylene glycol 6000.