7LXG

Homocitrullinated beta-lactamase OXA-48

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-06-28
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.00
Spacegroup name	P 62
Unit cell lengths	143.960, 143.960, 56.030
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.122 - 2.200
R-factor	0.1702
Rwork	0.168
R-free	0.21710
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4s2p
Data reduction software	MOSFLM
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.122	2.279
High resolution limit [Å]	2.200	2.200
Number of reflections	33900	3340
<I/σ(I)>	25.08
Completeness [%]	99.7
Redundancy	10.1
CC(1/2)	1.000	0.941

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298.15	0.2M lithium sulphate, 0.1M BIS-Tris pH 5.5, 25% w/v PEG 3350