2R5F

Putative sugar-binding domain of transcriptional regulator DeoR from Pseudomonas syringae pv. tomato

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-BM
Synchrotron site	APS
Beamline	19-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2006-06-14
Detector	CUSTOM-MADE
Wavelength(s)	0.97907, 0.97921
Spacegroup name	P 43
Unit cell lengths	42.112, 42.112, 144.782
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.400 - 2.100
R-factor	0.197
Rwork	0.195
R-free	0.25200
Structure solution method	MAD
RMSD bond length	0.015
RMSD bond angle	1.477
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MLPHARE
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.180
High resolution limit [Å]	2.100	2.100
Rmerge	0.081	0.434
Number of reflections	13180
<I/σ(I)>	10.6	2.65
Completeness [%]	89.5	72.7
Redundancy	7.7	4.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	291	0.1M Bis-Tris pH 6.5, 2M Ammonium sulfate, VAPOR DIFFUSION, SITTING DROP, temperature 291K