6EG2

Crystal structure of human BRM in complex with compound 16

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0
Spacegroup name	P 42 21 2
Unit cell lengths	136.790, 136.790, 120.690
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	96.730 - 2.980
R-factor	0.2536
Rwork	0.251
R-free	0.30370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1fqa 5hzr
RMSD bond length	0.010
RMSD bond angle	1.180
Data reduction software	XDS
Data scaling software	autoPROC
Phasing software	PHENIX
Refinement software	BUSTER (2.11.6)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	120.688	2.990
High resolution limit [Å]	2.980	2.980
Number of reflections	23436
<I/σ(I)>	18.2
Completeness [%]	97.9
Redundancy	12.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	100mM Hepes pH7.5, 200mM sodium chloride, 8% isopropanol