5K08

RecA mini intein-Zeise's salt complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL14-1
Synchrotron site	SSRL
Beamline	BL14-1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-03-26
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	1.07136
Spacegroup name	P 21 21 2
Unit cell lengths	57.687, 63.930, 37.307
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.222 - 1.401
R-factor	0.1822
Rwork	0.180
R-free	0.20990
Structure solution method	FOURIER SYNTHESIS
Starting model (for MR)	5i0a
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHENIX
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	100.000	100.000	1.420
High resolution limit [Å]	1.400	3.800	1.400
Rmerge	0.088	0.071	0.913
Rmeas	0.091
Rpim	0.025
Total number of observations	373588
Number of reflections	27687
<I/σ(I)>	10.8
Completeness [%]	99.4	98.4	96
Redundancy	13.5	12.3	10.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8.5	293	54%-59% (w/v) ammonium sulfate, 0.1 M Tris, pH 8.5, 2 mM Zeise's salt, 2 mM TCEP