6JXT

Crystal structure of EGFR 696-1022 WT in complex with AZD9291 prepared by cocrystallization

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-06-17
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97861
Spacegroup name	P 32 2 1
Unit cell lengths	86.749, 86.749, 103.939
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.375 - 2.307
R-factor	0.2176
Rwork	0.216
R-free	0.23930
RMSD bond length	0.013
RMSD bond angle	1.268
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.380
High resolution limit [Å]	2.300	2.300
Rpim	0.041
Number of reflections	20395
<I/σ(I)>	17.4
Completeness [%]	100.0
Redundancy	9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2 M Potassium sodium tartrate tetrahydrate, 20% w/v Polyethylene glycol 3350