6UDS

Crystal structure of a putative 3-oxoacyl-ACP reductase (FabG) from Acinetobacter baumannii

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-02-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.95366
Spacegroup name	P 43 21 2
Unit cell lengths	87.389, 87.389, 151.289
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.130 - 1.900
R-factor	0.189
Rwork	0.188
R-free	0.20620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4wjz
RMSD bond length	0.005
RMSD bond angle	0.790
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.130	1.940
High resolution limit [Å]	1.900	1.900
Rmerge	0.164	1.128
Rmeas	0.169	1.166
Rpim	0.040	0.288
Number of reflections	46833	3036
<I/σ(I)>	9.6	2
Completeness [%]	99.8
Redundancy	18
CC(1/2)	0.997	0.781

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		296.15	0.1 M Tris, pH 8.0, 2 M ammonium sulfate