5V2M

Mevalonate diphosphate mediated ATP binding mechanism of the mevalonate diphosphate decarboxylase from Enterococcus faecalis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-BM
Synchrotron site	APS
Beamline	19-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2013-08-16
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.9794
Spacegroup name	P 21 21 2
Unit cell lengths	81.934, 98.078, 46.078
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.673 - 1.989
R-factor	0.1807
Rwork	0.179
R-free	0.20350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5v2l
RMSD bond length	0.012
RMSD bond angle	1.101
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.070
High resolution limit [Å]	2.000	2.000
Rpim	0.027	0.058
Number of reflections	26117
<I/σ(I)>	17.4
Completeness [%]	95.4
Redundancy	5.9
CC(1/2)		0.991

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6	293	1.6 M ammonium sulfate, 50 mM sodium acetate, pH 4.6