6MDF

Mevalonate kinase from Methanosarcina mazei with 5-phosphomevalonate 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	2018-03-30
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9792
Spacegroup name	P 21 21 21
Unit cell lengths	53.970, 58.581, 190.030
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	51.920 - 2.460
R-factor	0.2038
Rwork	0.200
R-free	0.26720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4hac
RMSD bond length	0.003
RMSD bond angle	0.510
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	51.920	2.550
High resolution limit [Å]	2.460	2.460
Rmerge	0.103	0.375
Number of reflections	22260	2135
<I/σ(I)>	8.73	2.85
Completeness [%]	97.0	96.3
Redundancy	4.3	4
CC(1/2)	0.999	0.843

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	100 mM Bis-Tris, pH 5.5, 200-300 mM sodium potassium tartrate, 15-25% PEG8000