5DG3

Structure of Pseudomonas aeruginosa LpxA in complex with UDP-3-O-(R-3-hydroxydecanoyl)-GlcNAc

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	80
Detector technology	CCD
Collection date	2015-04-23
Detector	RAYONIX MX300HS
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	79.963, 83.328, 220.369
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	110.180 - 2.300
R-factor	0.1958
Rwork	0.193
R-free	0.24505
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.019
RMSD bond angle	1.816
Data scaling software	HKL-2000
Refinement software	REFMAC (5.8.0124)

Data quality characteristics

	Overall
Low resolution limit [Å]	110.180
High resolution limit [Å]	2.300
Number of reflections	65433
<I/σ(I)>	26.27
Completeness [%]	98.5
Redundancy	6.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2M calcium acetate, 0.1M imidazole pH8.0, 20% PEG 1000, 10mM UDP-3-O-(R-3-hydroxydecanoyl)-GlcNAc