5OY3

The structural basis of the histone demethylase KDM6B histone 3 lysine 27 specificity

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	80
Detector technology	CCD
Collection date	2016-04-28
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.873
Spacegroup name	P 41 21 2
Unit cell lengths	68.908, 68.908, 228.476
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.726 - 2.136
R-factor	0.1686
Rwork	0.165
R-free	0.22070
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3avr
RMSD bond length	0.012
RMSD bond angle	1.109
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.726
High resolution limit [Å]	2.136
Rmerge	0.174	1.397
Rmeas	0.182	1.463
Rpim	0.055	0.430
Number of reflections	31653
<I/σ(I)>	12.67
Completeness [%]	99.9
Redundancy	5.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	0.1M TRIS pH 7.5, 15%(v/v) Tert-butanol,