5WDD

Crystal structure of chicken BOK

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	CCD
Collection date	2016-03-18
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9537
Spacegroup name	P 1 21 1
Unit cell lengths	41.559, 59.620, 64.083
Unit cell angles	90.00, 96.26, 90.00

Refinement procedure

Resolution	36.526 - 1.799
R-factor	0.1973
Rwork	0.195
R-free	0.23170
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4bd8
RMSD bond length	0.005
RMSD bond angle	0.653
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.530	1.863
High resolution limit [Å]	1.799	1.799
Rmerge	0.066	2.155
Rpim	0.037	1.255
Number of reflections	28655	2803
<I/σ(I)>	12.93	0.8
Completeness [%]	98.5	95.75
Redundancy	3.9	3.7
CC(1/2)	0.999	0.593

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	3.5	293	22.5% PEG 3350, 90 mM trisodium citrate pH 3.5, 3% ethylene glycol