5LUQ

Crystal Structure of Human DNA-dependent Protein Kinase Catalytic Subunit (DNA-PKcs)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-05-23
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9791
Spacegroup name	P 1 21 1
Unit cell lengths	169.120, 132.640, 296.590
Unit cell angles	90.00, 105.53, 90.00

Refinement procedure

Resolution	49.920 - 4.300
R-factor	0.3874
Rwork	0.386
R-free	0.43700
Structure solution method	SAD
RMSD bond length	0.009
RMSD bond angle	1.542
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.10_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.920	4.410
High resolution limit [Å]	4.300	4.300
Rmerge	0.160	0.936
Number of reflections	84530
<I/σ(I)>	15.4	2.4
Completeness [%]	99.9	99.9
Redundancy	35.2	13.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M Bis-Tris, 200 mM NaCl, 30% glycerol, 10 mM EDTA, 18% PEG 8000
2	VAPOR DIFFUSION, HANGING DROP		293	0.1 M Bis-Tris, 200 mM NaCl, 30% glycerol, 10 mM EDTA, 8% PEG 8000