5VPA

Transcription factor FosB/JunD bZIP domain

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	2016-11-13
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.999
Spacegroup name	I 2 2 2
Unit cell lengths	52.605, 95.352, 98.200
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.204 - 2.830
R-factor	0.2484
Rwork	0.245
R-free	0.28280
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1fos
RMSD bond length	0.006
RMSD bond angle	0.685
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	34.204	34.204	2.850
High resolution limit [Å]	2.830	7.590	2.830
Rmerge	0.096	0.061	1.167
Rmeas	0.102	0.065	1.232
Rpim	0.033	0.022	0.390
Number of reflections	6010
<I/σ(I)>	25		2.2
Completeness [%]	100.0	99.7	100
Redundancy	9.5	8.7	9.5
CC(1/2)		0.992	0.826

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	293	3 M 1,6-Hexanediol, 50 mM Tris pH 8.5 and 5 mM MgCl2