4DFN

Crystal structure of spleen tyrosine kinase complexed with an adamantylpyrazine inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PILATUS 6M
Collection date	2009-04-09
Detector	DECTRIS
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	40.295, 84.848, 90.996
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	62.060 - 2.480
R-factor	0.222
Rwork	0.217
R-free	0.27340
Structure solution method	OTHER
Starting model (for MR)	NONE
RMSD bond length	0.006
RMSD bond angle	0.862
Data reduction software	XDS
Data scaling software	XSCALE
Refinement software	REFMAC (5.5.0088)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	62.060	2.640
High resolution limit [Å]	2.480	2.480
Rmerge	0.069	0.819
Number of reflections	11590
Completeness [%]	99.4	97.2
Redundancy	5.6	5.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1