6P97

OXA-48 carbapanemase, imipenem complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-11-19
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9795
Spacegroup name	P 21 21 21
Unit cell lengths	72.131, 76.210, 101.130
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.105 - 1.800
R-factor	0.1737
Rwork	0.172
R-free	0.20260
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.105	1.840
High resolution limit [Å]	1.800	1.800
Number of reflections	52357	3011
<I/σ(I)>	10.9	1.9
Completeness [%]	99.8
Redundancy	7.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	5 mM Ca2+, 5 mM Co2+, 5 mM Cd2+, 20% PEG 3350