5IA4

Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with foretinib (XL880)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P13 (MX1)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P13 (MX1)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-06-05
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0332
Spacegroup name	P 21 21 2
Unit cell lengths	80.769, 104.482, 34.536
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.385 - 1.797
R-factor	0.1904
Rwork	0.189
R-free	0.22550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1mqb
RMSD bond length	0.007
RMSD bond angle	0.889
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.870	1.910
High resolution limit [Å]	1.797	1.797
Number of reflections	52402
<I/σ(I)>	17.59
Completeness [%]	99.7
Redundancy	6.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	37.5 % MPD_P1k_P3350, 0.1 M AminoAcidsMix, 0.1 M MES pH 6.0