8PU2

Structure of the antitoxin ATfaRel2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	90
Detector technology	PIXEL
Collection date	2020-07-12
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9801
Spacegroup name	P 21 21 2
Unit cell lengths	53.289, 34.161, 37.612
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.520 - 1.240
R-factor	0.1881
Rwork	0.187
R-free	0.20840
Structure solution method	AB INITIO PHASING
RMSD bond length	0.006
RMSD bond angle	0.881
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.520	1.370
High resolution limit [Å]	1.240	1.240
Number of reflections	15179	759
<I/σ(I)>	13
Completeness [%]	92.6	46.5
Redundancy	12.6
CC(1/2)	0.998	0.711

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	15 % PEG 2000 MME pH 6.9