9IR2

phage HY126 hydroxylase AfhB with cofactor FMN and substrate dCMP

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	2024-06-08
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979
Spacegroup name	P 61 2 2
Unit cell lengths	64.600, 64.600, 230.210
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	50.320 - 1.310
R-factor	0.1556
Rwork	0.155
R-free	0.17950
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.861
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.320	1.340
High resolution limit [Å]	1.310	1.310
Rmerge	0.063	0.931
Number of reflections	66855	3365
<I/σ(I)>	32.8	1.8
Completeness [%]	96.2
Redundancy	28.6
CC(1/2)	1.000	0.850

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	0.2 M Ammonium citrate dibasic 20% w/v Polyethyele glycol 3350