4CW4

Crystal structure of the noncanonical ketosynthase FabY from P. aeruginosa

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-03-24
Detector	DECTRIS PILATUS 2M
Spacegroup name	C 2 2 21
Unit cell lengths	99.370, 123.310, 100.620
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.685 - 1.349
R-factor	0.1482
Rwork	0.148
R-free	0.17700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1kas
RMSD bond length	0.009
RMSD bond angle	1.292
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((PHENIX.REFINE))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.680	1.380
High resolution limit [Å]	1.349	1.349
Rmerge	0.056	1.080
Number of reflections	134980
<I/σ(I)>	14.3	1.33
Completeness [%]	99.3	97.7
Redundancy	6.5	2.98

Crystallization Conditions

crystal ID	method	pH	temperature	details
1