3CJJ

Crystal structure of human rage ligand-binding domain

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	CCD
Collection date	2006-08-21
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.008, 1.28, 1.283
Spacegroup name	P 21 21 2
Unit cell lengths	74.850, 119.960, 28.890
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.000 - 1.850
R-factor	0.21
Rwork	0.209
R-free	0.24000
Structure solution method	MAD
RMSD bond length	0.018
RMSD bond angle	1.988
Data scaling software	XSCALE
Phasing software	SHELX
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	35.180	35.180	2.000
High resolution limit [Å]	1.850	10.000	1.850
Rmerge	0.090	0.041	0.589
Number of reflections	23066	143	4712
<I/σ(I)>	11.38	19.9	3.2
Completeness [%]	99.8	77.3	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	0.1M Na cacodylate, 0.2M Zn acetate, 11% PEG 8000, pH 6.5, vapor diffusion, hanging drop, temperature 298K