8EBC

Crystal Structure of the Catalytic Domain of the Inosine Monophosphate Dehydrogenase from Listeria monocytogenes in the complex with IMP

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	2014-06-12
Detector	DECTRIS PILATUS3 X 6M
Wavelength(s)	0.97915
Spacegroup name	P 1
Unit cell lengths	78.977, 95.699, 97.604
Unit cell angles	111.36, 105.17, 107.61

Refinement procedure

Resolution	39.880 - 2.500
R-factor	0.1961
Rwork	0.194
R-free	0.23860
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDBID 1PVN
RMSD bond length	0.002
RMSD bond angle	0.427
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	HKL-3000
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.540
High resolution limit [Å]	2.500	2.500
Rmerge	0.056	0.426
Rpim	0.051
Number of reflections	78331	3560
<I/σ(I)>	13.11	1.71
Completeness [%]	97.7	88.6
Redundancy	2.2	2
CC(1/2)		0.784

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.6	289	0.2 M ammonium formate pH 6.6, 20 % (w/v) PEG