8AVK

Superoxide dismutase SodFM1 from CPR Parkubacteria Wolfebacteria

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-09-18
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.89843
Spacegroup name	P 1 21 1
Unit cell lengths	46.531, 70.586, 57.788
Unit cell angles	90.00, 100.30, 90.00

Refinement procedure

Resolution	56.857 - 2.100
Rwork	0.209
R-free	0.25630
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ix9
RMSD bond length	0.011
RMSD bond angle	1.827
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0352)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	70.590	2.160
High resolution limit [Å]	2.100	2.100
Number of reflections	21632	1781
<I/σ(I)>	7.3	1
Completeness [%]	100.0
Redundancy	14.1
CC(1/2)	0.996	0.640

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	100 mM sodium acetate trihydrate pH 4.5 and 25% w/v polyethylene glycol 3350.