9CDX

Crystal structure of DLK with inhibitor bound

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-11-29
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.00
Spacegroup name	P 1 21 1
Unit cell lengths	57.619, 39.960, 62.503
Unit cell angles	90.00, 106.50, 90.00

Refinement procedure

Resolution	47.970 - 2.380
Rwork	0.234
R-free	0.28400
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	Aimless (0.7.2)
Phasing software	PHASER
Refinement software	PRIME-X

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.970	2.470
High resolution limit [Å]	2.380	2.380
Rmerge	0.187	1.249
Rmeas	0.248
Rpim	0.161
Number of reflections	11162	1176
<I/σ(I)>	4.2
Completeness [%]	99.6	99.9
Redundancy	3.9	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	15.9% PEG 3350, 0.1M Magnesium Acetate, 0.1M HEPES