6WH0

Crystal structure of HyBcl-2-4 with HyBax BH3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-03-14
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9537
Spacegroup name	P 1 21 1
Unit cell lengths	53.401, 69.726, 72.523
Unit cell angles	90.00, 96.63, 90.00

Refinement procedure

Resolution	50.100 - 1.990
R-factor	0.2324
Rwork	0.231
R-free	0.26810
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1pq1
RMSD bond length	0.007
RMSD bond angle	0.991
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER (1.17.1_3660)
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	71.800	2.000
High resolution limit [Å]	1.990	1.990
Rmerge	0.148	1.250
Number of reflections	34508	1855
<I/σ(I)>	3.7	1.1
Completeness [%]	94.3	99.9
Redundancy	3.4
CC(1/2)	0.990	0.450

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	293	0.2M Magnesium chloride hexahydrate, 0.1 Bis Tris pH 5.5, 25% PEG 3350