6TEL

Crystal structure of Dot1L in complex with an inhibitor (compound 10).

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-04-26
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	1.00006
Spacegroup name	P 63
Unit cell lengths	159.160, 159.160, 74.140
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	42.630 - 2.190
R-factor	0.187
Rwork	0.185
R-free	0.21200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5drt
RMSD bond length	0.010
RMSD bond angle	1.010
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	BUSTER (2.11.7)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	42.630	42.630	2.250
High resolution limit [Å]	2.190	9.790	2.190
Rmerge	0.077	0.022	1.156
Rmeas	0.082	0.023	1.217
Total number of observations	566480
Number of reflections	55193	658	4039
<I/σ(I)>	20.07	72.06	2.11
Completeness [%]	99.9	98.8	99.3
Redundancy	10.264	10.027	10.292

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	1.28 M K/Na tartrate 0.1 M Hepes pH 7.0