8F1Z

EGFR kinase in complex with Bayer #33

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-03-11
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	I 2 3
Unit cell lengths	146.131, 146.131, 146.131
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	59.660 - 2.400
R-factor	0.1927
Rwork	0.192
R-free	0.21160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2gs2
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	59.660	59.680	2.440
High resolution limit [Å]	2.400	6.510	2.400
Rmeas	0.090	0.044	0.671
Rpim	0.038	0.018	0.296
Total number of observations	102981	5183	4858
Number of reflections	20163	1049	1029
<I/σ(I)>	11.2	36.6	0.9
Completeness [%]	98.6	96.4	99.7
Redundancy	5.1	4.9	4.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	0.1 M MES pH 6.5, 1.1 M Sodium Citrate