7Z76

Crystal structure of compound 10 in complex with the bromodomain of human SMARCA2 and pVHL:ElonginC:ElonginB

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-03-22
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.999
Spacegroup name	P 1 21 1
Unit cell lengths	47.469, 101.395, 69.131
Unit cell angles	90.00, 105.56, 90.00

Refinement procedure

Resolution	33.960 - 1.320
R-factor	0.179
Rwork	0.178
R-free	0.20200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5t35 4qy4
RMSD bond length	0.008
RMSD bond angle	0.950
Data reduction software	XDS
Data scaling software	STARANISO
Phasing software	BUSTER
Refinement software	BUSTER (2.11.7)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.590	1.450
High resolution limit [Å]	1.320	1.320
Number of reflections	104311	5216
<I/σ(I)>	12.1
Completeness [%]	92.0
Redundancy	4.5
CC(1/2)	0.999	0.510

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.8	293	14.5 % PEG 3350, 0.1 M BIS-TRIS propane pH 5.8, 100 mM sodium iodide