8QPJ

FAD-independent Methylene-Tetrahydrofolate Reductase Mutant E9Q from Mycobacterium hassiacum

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-11-25
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.00
Spacegroup name	P 43
Unit cell lengths	45.800, 45.800, 254.600
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.800 - 1.750
Rwork	0.200
R-free	0.23150
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.800	1.813
High resolution limit [Å]	1.750	1.750
Rmerge	0.088	1.050
Number of reflections	51871	5183
<I/σ(I)>	8.17
Completeness [%]	98.7
Redundancy	3.3
CC(1/2)	0.997	0.431

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		281	25 % PEG MME 5000 10 mg/ml Mfr_E9Q 2 mM NAD+ 2 mM CH3-H4F