2PEI

Crystal structure of selenomethionine-labeled RbcX

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Temperature [K]	100
Detector technology	CCD
Collection date	2005-07-01
Detector	ADSC QUANTUM 4
Wavelength(s)	0.97950
Spacegroup name	P 1
Unit cell lengths	70.362, 71.102, 113.162
Unit cell angles	89.58, 81.10, 80.09

Refinement procedure

Resolution	20.000 - 2.700
R-factor	0.215
Rwork	0.212
R-free	0.26200
Structure solution method	SAD
RMSD bond length	0.020
RMSD bond angle	1.683
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	SHARP
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	111.803	68.520	2.850
High resolution limit [Å]	2.700	8.540	2.700
Rmerge	0.101	0.043	0.420
Total number of observations		6640	31838
Number of reflections	56794
<I/σ(I)>	6.2	12.9	1.5
Completeness [%]	96.9	97.4	96.3
Redundancy	3.9	3.7	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293	30% PEG 4000, 0.1 M Tris-HCl pH 8.5, 0.2 M Sodium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 293K