4LFG

Crystal structure of geranylgeranyl diphosphate synthase sub1274 (target efi-509455) from streptococcus uberis 0140j with bound magnesium and isopentyl diphosphate, fully liganded complex;

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X29A
Synchrotron site	NSLS
Beamline	X29A
Temperature [K]	100
Detector technology	CCD
Collection date	2013-04-18
Detector	ADSC QUANTUM 315
Wavelength(s)	1.075
Spacegroup name	P 21 21 21
Unit cell lengths	70.385, 74.326, 124.473
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.670 - 1.760
R-factor	0.15368
Rwork	0.153
R-free	0.18354
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4gp1
RMSD bond length	0.008
RMSD bond angle	1.228
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.790
High resolution limit [Å]	1.760	1.760
Rmerge	0.107	0.665
Number of reflections	65193
<I/σ(I)>	8.6	2.8
Completeness [%]	99.3	89.8
Redundancy	6.1	5.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.5		0.2M MAGNESIUM CHLORIDE, 0.1M MES-NAOH, PH 6.5, 25% PEG4000, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 298K