4KKM

Crystal structure of a FPP/GFPP synthase (Target EFI-501952) from Zymomonas mobilis, apo structure

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 31-ID
Synchrotron site	APS
Beamline	31-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2012-07-20
Detector	RAYONIX MX225HE
Wavelength(s)	0.9793
Spacegroup name	P 41 21 2
Unit cell lengths	73.414, 73.414, 229.419
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.961 - 1.900
R-factor	0.1823
Rwork	0.181
R-free	0.20640
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3m0g
RMSD bond length	0.005
RMSD bond angle	0.886
Data reduction software	MOSFLM
Data scaling software	SCALA (3.3.20)
Phasing software	AMoRE
Refinement software	PHENIX (1.8.1_1168)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	69.921	34.961	2.000
High resolution limit [Å]	1.900	6.010	1.900
Rmerge	0.138	0.012	0.012
Total number of observations		22697	105515
Number of reflections	50674
<I/σ(I)>	14.2	16.8	0.6
Completeness [%]	100.0	99.3	100
Redundancy	14.3	12.4	14.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	298	protein (10 mM HEPES, pH 7.5, 150 mM sodium chloride, 10% glycerol, 1 mM DTT, 5 mM magnesium chloride), reservoir (0.2 M calcium acetate, 0.1 M MES, pH 6.0, 20% PEG8000), cryoprotectant (reservoir + 20% glycerol), VAPOR DIFFUSION, SITTING DROP, temperature 298K