6MO5

Co-Crystal structure of P. aeruginosa LpxC-50228 complex

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]	100
Detector technology	CCD
Collection date	2015-08-23
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	36.101, 66.486, 63.565
Unit cell angles	90.00, 90.59, 90.00

Refinement procedure

Resolution	33.240 - 1.851
R-factor	0.1795
Rwork	0.177
R-free	0.21900
RMSD bond length	0.006
RMSD bond angle	0.860
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	33.240	1.890
High resolution limit [Å]	1.850	1.850
Number of reflections	24354
<I/σ(I)>	9.82
Completeness [%]	99.8
Redundancy	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	50 mM MgCl2, 30% PEG MME 5000 and 0.2 M KSCN