5CIY

Structural basis of the recognition of H3K36me3 by DNMT3B PWWP domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-06-27
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9801
Spacegroup name	H 3 2
Unit cell lengths	95.335, 95.335, 314.688
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	36.554 - 1.594
R-factor	0.1664
Rwork	0.165
R-free	0.18830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	9mht
RMSD bond length	0.006
RMSD bond angle	1.161
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (2.5.2)
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000		1.690
High resolution limit [Å]	1.590	4.760	1.590
Rmerge	0.045	0.024	0.694
Rmeas	0.049	0.026	0.808
Total number of observations	477758
Number of reflections	72764	2864	10955
<I/σ(I)>	25.05	53.13	2.08
Completeness [%]	98.5	96.4	92.7
Redundancy	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	298	AMMONIUM SULFATE 1.8 M, CITRATE 50mM