9IKD

The apo structure of the MazF-mt3 toxin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-03-30
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 43 21 2
Unit cell lengths	110.795, 110.795, 271.217
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	75.270 - 3.320
R-factor	0.2439
Rwork	0.242
R-free	0.27880
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.610
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	75.270	3.500
High resolution limit [Å]	3.320	3.320
Rmerge	0.157	1.309
Number of reflections	24018	2906
<I/σ(I)>	18.4	2.8
Completeness [%]	92.7
Redundancy	24.2
CC(1/2)	0.999	0.915

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	1-1.5 M NaCl, 0.1 M NaOAc pH4.5