9OO3

N-terminal Six-His-Tagged FosB from Enterococcus faecium in complex with phosphonoacetate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	DIFFRACTOMETER
Collection date	2025-03-15
Detector	RIGAKU
Wavelength(s)	1.54
Spacegroup name	P 41 21 2
Unit cell lengths	76.323, 76.323, 118.125
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	26.980 - 2.500
R-factor	0.2361
Rwork	0.232
R-free	0.27610
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.510
Data reduction software	CrysalisPro
Data scaling software	CrysalisPro
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	26.980	2.530
High resolution limit [Å]	2.500	2.500
Number of reflections	24239	774
<I/σ(I)>	5.79
Completeness [%]	99.8
Redundancy	7.2
CC(1/2)	0.993	0.008

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	PEG 3350, magnesium chloride