7I8L

Crystal Structure of 61c bound to CK2a

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-08-07
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9999
Spacegroup name	P 1 21 1
Unit cell lengths	58.489, 46.245, 63.299
Unit cell angles	90.00, 112.13, 90.00

Refinement procedure

Resolution	54.180 - 1.480
R-factor	0.184
Rwork	0.183
R-free	0.20300
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.020
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	58.700	1.510
High resolution limit [Å]	1.440	1.440
Rmerge	0.242	5.235
Rmeas	0.247	5.341
Rpim	0.049	1.048
Total number of observations	1440077	212429
Number of reflections	57622	8349
<I/σ(I)>	11.9	1.1
Completeness [%]	100.0
Redundancy	25	25.4
CC(1/2)	0.999	0.425

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	112.5 mM MES pH 6.5, 35% glycerol ethoxylate and 180 mM ammonium acetate