6OSS

Crystal Structure of the Acyl-Carrier-Protein UDP-N-Acetylglucosamine O-Acyltransferase LpxA from Proteus mirabilis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-27
Detector	DECTRIS PILATUS3 X 6M
Wavelength(s)	0.97940
Spacegroup name	P 21 21 21
Unit cell lengths	70.789, 94.507, 136.178
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.642 - 2.190
R-factor	0.2188
Rwork	0.217
R-free	0.25640
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDBID 4J09
RMSD bond length	0.002
RMSD bond angle	0.486
Data reduction software	xia2
Data scaling software	xia2
Phasing software	HKL-3000
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	77.600	2.230
High resolution limit [Å]	2.190	2.190
Rmerge	0.091	0.882
Number of reflections	47819	2315
<I/σ(I)>	13.4
Completeness [%]	99.9
Redundancy	12.6	2.1
CC(1/2)	1.000	0.447

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	289	0.1 M Tris pH 8.5, 25 % PEG5K MME, 0.2 M ammonium sulfate