5F83

Imipenem complex of the GES-5 C69G mutant

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	2014-07-14
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9795
Spacegroup name	P 1 21 1
Unit cell lengths	42.920, 81.483, 71.716
Unit cell angles	90.00, 101.97, 90.00

Refinement procedure

Resolution	35.801 - 1.380
R-factor	0.1412
Rwork	0.140
R-free	0.17100
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.950
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.300	1.420
High resolution limit [Å]	1.380	1.380
Rmerge	0.042	0.249
Number of reflections	99237
<I/σ(I)>	17.1	4.3
Completeness [%]	97.4	90.8
Redundancy	3.4	2.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	278	0.2 M D,L-malic acid, 20% PEG3350