4NBV

Crystal structure of FabG from Cupriavidus taiwanensis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	298
Detector technology	CCD
Collection date	2012-09-29
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.000
Spacegroup name	P 43 21 2
Unit cell lengths	111.763, 111.763, 79.198
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.403 - 1.645
R-factor	0.1368
Rwork	0.136
R-free	0.15430
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1q7b
RMSD bond length	0.009
RMSD bond angle	1.173
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.325	1.686
High resolution limit [Å]	1.640	1.645
Number of reflections	58825
Completeness [%]	96.0	95.95

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.6	298	0.1 Sodium Malonate pH 7.0, 0.03 M Citric Acid, 0.07 M Bis-Tris propane pH 7.6 and 20 % PEG 3,350, VAPOR DIFFUSION, SITTING DROP, temperature 298K