9BHI

Crystal structure of the MerTK kinase domain with SA4488

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-03-08
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.000000
Spacegroup name	P 43 21 2
Unit cell lengths	79.555, 79.555, 135.422
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	68.590 - 2.070
R-factor	0.2111
Rwork	0.210
R-free	0.23030
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.880
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	BUSTER (2.11.8)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	68.600	2.100
High resolution limit [Å]	2.070	2.070
Rmerge	0.096	1.476
Number of reflections	27321	1544
<I/σ(I)>	12.9
Completeness [%]	100.0
Redundancy	6.7
CC(1/2)	0.999

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		296	3.0 M sodium chloride, 0.1 M Bis-Tris, pH 5.5