4XEY

Crystal structure of an SH2-kinase domain construct of c-Abl tyrosine kinase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.3.1
Synchrotron site	ALS
Beamline	8.3.1
Temperature [K]	100
Detector technology	CCD
Collection date	2009-12-10
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.1159
Spacegroup name	P 21 21 2
Unit cell lengths	114.118, 125.449, 56.232
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.799 - 2.891
R-factor	0.2323
Rwork	0.231
R-free	0.25930
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2gqg 1opk
RMSD bond length	0.003
RMSD bond angle	0.805
Data reduction software	HKL-2000 (2.3.6)
Data scaling software	HKL-2000 (2.3.6)
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.960	2.950
High resolution limit [Å]	2.890	2.890
Number of reflections	18720
<I/σ(I)>	9.24	2.1
Completeness [%]	99.6	99.6
Redundancy	4	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5	293	0.1M sodium citrate, 8% PEG 8000