5X2C

Crystal structure of EGFR 696-1022 T790M/V948R in complex with SKLB(5)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER AXS MICROSTAR
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2011-08-06
Detector	MARRESEARCH
Wavelength(s)	1.5418
Spacegroup name	C 1 2 1
Unit cell lengths	155.758, 72.451, 76.159
Unit cell angles	90.00, 113.41, 90.00

Refinement procedure

Resolution	37.891 - 2.050
R-factor	0.1753
Rwork	0.175
R-free	0.20180
RMSD bond length	0.017
RMSD bond angle	1.594
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall
Low resolution limit [Å]	100.000
High resolution limit [Å]	2.050
Number of reflections	48272
<I/σ(I)>	11.8
Completeness [%]	98.7
Redundancy	2.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1M Bis-Tris 5.0, 22.5% PEG 3350, 5mM TCEP