3THG

Crystal structure of the creosote Rubisco activase C-domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2011-03-16
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97921
Spacegroup name	H 3 2
Unit cell lengths	71.919, 71.919, 151.698
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	48.130 - 1.880
R-factor	0.21691
Rwork	0.216
R-free	0.23803
RMSD bond length	0.016
RMSD bond angle	1.742
Data scaling software	SCALA (3.3.16)
Phasing software	SHELX
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.135	48.135	1.980
High resolution limit [Å]	1.880	5.950	1.880
Rmerge		0.033	0.536
Number of reflections	12496
<I/σ(I)>	22.1	14.5	1.4
Completeness [%]	99.6	99.5	97.2
Redundancy	9.9	10.6	7.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	283	0.1 M Tris, 0.2 M trimethylamine N-oxide, 20% PEG MME 2000, pH 8.5, vapor diffusion, hanging drop, temperature 283K
1	VAPOR DIFFUSION, HANGING DROP	8.5	283	0.1 M Tris, 0.2 M trimethylamine N-oxide, 20% PEG MME 2000, pH 8.5, vapor diffusion, hanging drop, temperature 283K
1	VAPOR DIFFUSION, HANGING DROP	8.5	283	0.1 M Tris, 0.2 M trimethylamine N-oxide, 20% PEG MME 2000, pH 8.5, vapor diffusion, hanging drop, temperature 283K
1	VAPOR DIFFUSION, HANGING DROP	8.5	283	0.1 M Tris, 0.2 M trimethylamine N-oxide, 20% PEG MME 2000, pH 8.5, vapor diffusion, hanging drop, temperature 283K