1T3G

Crystal structure of the Toll/interleukin-1 receptor (TIR) domain of human IL-1RAPL

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4A
Synchrotron site	NSLS
Beamline	X4A
Temperature [K]	100
Detector technology	CCD
Collection date	2003-02-02
Detector	ADSC QUANTUM 4
Wavelength(s)	0.9793, 0.9792, 0.9200
Spacegroup name	P 21 21 21
Unit cell lengths	51.987, 53.265, 183.250
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.880 - 2.300
R-factor	0.228
Rwork	0.228
R-free	0.27200
Structure solution method	MAD
RMSD bond length	0.006
RMSD bond angle	1.200
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SOLVE
Refinement software	CNS (1.1)

Data quality characteristics

	Overall
Low resolution limit [Å]	20.000
High resolution limit [Å]	2.300
Rmerge	0.054
Number of reflections	41323
Completeness [%]	94.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6	277	PEG 4000, SODIUM ACETATE, DTT, GLYCEROL, pH 4.6, VAPOR DIFFUSION, SITTING DROP, temperature 277K