7SXF

BIO-2895 (BRD0705) bound GSK3alpha-axin complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	93
Detector technology	PIXEL
Collection date	2019-05-23
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97
Spacegroup name	C 1 2 1
Unit cell lengths	119.930, 55.710, 66.560
Unit cell angles	90.00, 97.71, 90.00

Refinement procedure

Resolution	47.430 - 1.940
R-factor	0.2032
Rwork	0.201
R-free	0.23470
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5kpm
RMSD bond length	0.006
RMSD bond angle	0.881
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.430	2.010
High resolution limit [Å]	1.940	1.940
Rmerge		0.140
Number of reflections	31698	11370
<I/σ(I)>	24.4
Completeness [%]	97.8
Redundancy	3.5
CC(1/2)	0.990	0.980

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	0.2M calcium acetate, 0.1M BisTRIS pH 7.0, 5% Glycerol and 17% PEG3350