9FHN

Crystal structure of the arginine kinase Der p 20.0101

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	LIQUID ANODE
Source details	Excillum MetalJet D2+ 70 kV
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-05-19
Detector	Bruker PHOTON III
Wavelength(s)	1.34138
Spacegroup name	P 1 21 1
Unit cell lengths	48.280, 99.020, 77.883
Unit cell angles	90.00, 108.06, 90.00

Refinement procedure

Resolution	59.300 - 1.900
Rwork	0.270
R-free	0.30980
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	1.232
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	59.300	1.940
High resolution limit [Å]	1.900	1.900
Rmerge	0.144	0.500
Number of reflections	49720	3229
<I/σ(I)>	4.3
Completeness [%]	90.8
Redundancy	2.9
CC(1/2)	0.978	0.708

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH		293	0.2 M Lithium sulfate monohydrate, 0.1 M BIS-TRIS pH 5.5, 25% w/v Polyethylene glycol 3,350