5C8N

EGFR kinase domain mutant "TMLR" with compound 23

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	110
Detector technology	PIXEL
Collection date	2013-07-03
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97950
Spacegroup name	I 2 3
Unit cell lengths	145.932, 145.932, 145.932
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.000 - 2.401
R-factor	0.20445
Rwork	0.202
R-free	0.25822
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.224
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall
Low resolution limit [Å]	39.000
High resolution limit [Å]	2.400
Number of reflections	20144
<I/σ(I)>	26.9
Completeness [%]	99.0
Redundancy	6.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	292	PEG 10000, ethylene glycol