3T8E

Crystal structure of CerJ from Streptomyces tendae soaked with CerviK

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	CCD
Collection date	2011-02-10
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.0
Spacegroup name	P 41 21 2
Unit cell lengths	106.070, 106.070, 121.110
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.340 - 2.100
R-factor	0.16266
Rwork	0.161
R-free	0.19841
RMSD bond length	0.012
RMSD bond angle	1.337
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	REFMAC (- Rigid Body)
Refinement software	REFMAC (- Rigid Body)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.150
High resolution limit [Å]	2.100	2.100
Rmerge		0.435
Number of reflections	40821
<I/σ(I)>		3.95
Completeness [%]	99.7	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	22.5% PEG 4000, 100 mM Tris/HCl pH 8.5, 200 mM sodium acetate , VAPOR DIFFUSION, HANGING DROP, temperature 293K