8BIN

Crystal structure of human Ephrin type-A receptor 2 (EPHA2) Kinase domain in complex with MR21

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-10-15
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.999990
Spacegroup name	P 1 21 1
Unit cell lengths	32.803, 107.678, 40.661
Unit cell angles	90.00, 108.94, 90.00

Refinement procedure

Resolution	38.490 - 1.500
R-factor	0.13353
Rwork	0.132
R-free	0.17095
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5nki
RMSD bond length	0.009
RMSD bond angle	1.473
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0352)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.490	1.530
High resolution limit [Å]	1.500	1.500
Number of reflections	35835	726
<I/σ(I)>	14.8
Completeness [%]	84.2
Redundancy	6.9
CC(1/2)	0.998	0.825

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	20% PEG3350, 10% ethylene glycol, 0.2M potassium thiocyanate