5HNA

Crystal structure of Plasmodium vivax geranylgeranylpyrophosphate synthase complexed with BPH-1251

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	293
Detector technology	CCD
Collection date	2011-04-23
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.97872
Spacegroup name	P 21 21 21
Unit cell lengths	107.447, 108.616, 140.668
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.961 - 2.693
R-factor	0.1959
Rwork	0.192
R-free	0.26700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ldw
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155))

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.693
Number of reflections	46114
<I/σ(I)>	11.16
Completeness [%]	100.0
Redundancy	9.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	291	100MM TRIS, 200MM LITHIUM SULFATE, 22% PEG 3,350, PH 8.5