4R7J

Crystal Structure of Inosine 5'-monophosphate Dehydrogenase with the Internal Deletion Containing CBS Domain from Campylobacter jejuni

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	CCD
Collection date	2012-06-20
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97926
Spacegroup name	P 4 21 2
Unit cell lengths	119.413, 119.413, 69.394
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.219 - 2.117
R-factor	0.174
Rwork	0.173
R-free	0.20470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	PDBID 4FO4
RMSD bond length	0.003
RMSD bond angle	0.702
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	HKL-3000
Refinement software	PHENIX ((phenix.refine: dev_1745))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.160
High resolution limit [Å]	2.117	2.117
Number of reflections	29178
<I/σ(I)>	33.7	3.9
Completeness [%]	100.0	100
Redundancy	12	12.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	289	0.2 M lithium sulfate monohydrate,0.1 M MES pH 6.0, 35 %(v/v) 2-methyl-2,4-pentanediol, VAPOR DIFFUSION, SITTING DROP, temperature 289K