36WK

Mevalonate kinase from Saccharomyces cerevisiae with dimethylallyl pyrophosphate (DMAPP) bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-03
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	P 43 21 2
Unit cell lengths	83.450, 83.450, 262.880
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	60.430 - 1.930
R-factor	0.1901
Rwork	0.189
R-free	0.20910
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.007
RMSD bond angle	0.890
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	83.630	1.980
High resolution limit [Å]	1.930	1.930
Number of reflections	70272	4457
<I/σ(I)>	8.5
Completeness [%]	99.2
Redundancy	4.5
CC(1/2)	0.998	0.447

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	298	100 mM MES pH 6.0, 900-1100 mM sodium potassium tartrate