5D11

Kinase domain of cSrc in complex with RL235

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2011-06-27
Detector	PSI PILATUS 6M
Wavelength(s)	1.00
Spacegroup name	P 1
Unit cell lengths	42.120, 63.430, 75.350
Unit cell angles	78.65, 89.55, 90.29

Refinement procedure

Resolution	43.540 - 2.300
R-factor	0.216
Rwork	0.214
R-free	0.26890
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2oiq
RMSD bond length	0.019
RMSD bond angle	1.934
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0124)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	45.000	45.000	2.400
High resolution limit [Å]	2.300	16.000	2.300
Rmerge	0.065	0.025	0.344
Rmeas	0.078	0.029	0.413
Total number of observations	115170
Number of reflections	33021	99	3895
<I/σ(I)>	15.35	43.04	4.41
Completeness [%]	97.1	96.1	95.7
Redundancy	3.48

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.085-0.125 mM MES, 9-11.5 % PEG20000