9HLO

AbiEi (antitoxin) AbiEii (toxin) toxin-antitoxin heterodimer complex from Streptococcus agalactiae

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-11-15
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.9795
Spacegroup name	I 1 2 1
Unit cell lengths	84.355, 86.796, 85.245
Unit cell angles	90.00, 118.27, 90.00

Refinement procedure

Resolution	72.784 - 2.200
R-factor	0.2311
Rwork	0.228
R-free	0.27370
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.945
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.14_3260))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	72.784	2.280
High resolution limit [Å]	2.200	2.200
Rmerge	0.014	0.074
Rmeas	0.020	0.105
Number of reflections	27558	2757
<I/σ(I)>	26.2	3.9
Completeness [%]	100.0	100
Redundancy	2	2
CC(1/2)	1.000	0.991

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	291	0.2 M potassium acetate, 0.1 M MES pH 6.0, 15% v/v pentaerythritol ethoxyloate (15/4 EO/OH)