5IFZ

Crystal Structure of Ribose-5-phosphate Isomerase from Brucella melitensis 16M

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2014-04-03
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.97872
Spacegroup name	P 43 21 2
Unit cell lengths	51.570, 51.570, 177.290
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.323 - 1.600
R-factor	0.1827
Rwork	0.181
R-free	0.21150
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3he8
RMSD bond length	0.005
RMSD bond angle	0.697
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (dev_2313)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	44.935	44.935	1.640
High resolution limit [Å]	1.600	7.160	1.600
Rmerge	0.040	0.026	0.482
Number of reflections	32358
<I/σ(I)>	26.12	51.05	3.5
Completeness [%]	98.7	66.2	99.8
Redundancy	7.81		7.97
CC(1/2)	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.5	290	MCSG-1 a5(250341a5): 0.2 M Sodium Chloride, 0.1 M Sodium Acetate: Acetic Acid pH 4.5, 1.26 M Ammomium Sulfate; cryo: 20% GLYCEROL; BrmeA.00966.a.B1.PW37380 at 25.8 mg/ml, puck twt3-5