3H20

Crystal structure of primase RepB'

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-2
Synchrotron site	ESRF
Beamline	ID14-2
Temperature [K]	100
Detector technology	CCD
Collection date	2006-07-04
Detector	ADSC QUANTUM 4
Wavelength(s)	0.931
Spacegroup name	P 43 21 2
Unit cell lengths	91.740, 91.740, 83.480
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.630 - 1.990
R-factor	0.197
Rwork	0.195
R-free	0.23200
Structure solution method	MAD
RMSD bond length	0.010
RMSD bond angle	1.096
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SHELX
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.036
High resolution limit [Å]	1.980	1.985
Number of reflections	24774
Completeness [%]	99.8	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	0.3M ammonium sulfate, 22% (wt/vol) PEG monomethyl ether 2000, 5% (vol/vol) gamma-butyrolactone, 100mM sodium acetate pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	0.3M ammonium sulfate, 22% (wt/vol) PEG monomethyl ether 2000, 5% (vol/vol) gamma-butyrolactone, 100mM sodium acetate pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	0.3M ammonium sulfate, 22% (wt/vol) PEG monomethyl ether 2000, 5% (vol/vol) gamma-butyrolactone, 100mM sodium acetate pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	0.3M ammonium sulfate, 22% (wt/vol) PEG monomethyl ether 2000, 5% (vol/vol) gamma-butyrolactone, 100mM sodium acetate pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K
1	VAPOR DIFFUSION, HANGING DROP	5.5	298	0.3M ammonium sulfate, 22% (wt/vol) PEG monomethyl ether 2000, 5% (vol/vol) gamma-butyrolactone, 100mM sodium acetate pH 5.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K