3GFH

Crystal structure of EUTL shell protein of the bacterial ethanolamine micrompartment

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-1
Synchrotron site	SSRL
Beamline	BL9-1
Temperature [K]	100
Detector technology	CCD
Detector	ADSC QUANTUM 315r
Spacegroup name	P 3
Unit cell lengths	67.384, 67.384, 79.661
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.650 - 2.200
R-factor	0.223
Rwork	0.223
R-free	0.27800
Structure solution method	SAD
Starting model (for MR)	MODEL WAS DERIVED FROM FITTING INTO A 3.5 A SAD DENSITY DERIVED FROM TWO MERCURY ATOMS.
RMSD bond length	0.021
RMSD bond angle	2.289
Data reduction software	AND (XDS)
Data scaling software	AND (SCALEIT)
Phasing software	SOLVE
Refinement software	REFMAC (5.5.0066)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.950	2.300
High resolution limit [Å]	1.950	1.950
Rmerge	0.080	0.278
Number of reflections	51500
<I/σ(I)>		4.46
Completeness [%]	85.8	74.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.5	298	2M Nacl, 100mM phosphate, MES buffer pH6.5, 5% PEG 400, VAPOR DIFFUSION, HANGING DROP, temperature 298K