8A51

Crystal structure of HSF2BP-BRME1 complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-1
Synchrotron site	ESRF
Beamline	MASSIF-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-02-17
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.96546
Spacegroup name	I 41 2 2
Unit cell lengths	73.866, 73.866, 92.801
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.930 - 1.900
R-factor	0.2351
Rwork	0.235
R-free	0.24300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	AlfaFold2 model
RMSD bond length	0.007
RMSD bond angle	0.790
Data reduction software	XDS (Jan 10, 2022 BUILT=20220110)
Data scaling software	STARANISO (2.3.77)
Phasing software	PHASER
Refinement software	BUSTER (2.10.4 (3-FEB-2022))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.930	1.950
High resolution limit [Å]	1.900	1.900
Rmerge	0.049	2.384
Rmeas		2.586
Rpim	0.019	0.976
Number of reflections	6522	753
<I/σ(I)>	20.3	0.7
Completeness [%]	99.6	99.6
Redundancy	6.9	6.9
CC(1/2)	0.999	0.421

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	0.1 M HEPES sodium salt, pH 7.5, 40% PEG200