9UTH

DPF3b in complex with H3K14cr peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-05-04
Detector	DECTRIS PILATUS3 X 6M
Wavelength(s)	0.97918
Spacegroup name	P 21 21 21
Unit cell lengths	70.088, 84.253, 111.123
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.110 - 2.690
R-factor	0.1844
Rwork	0.181
R-free	0.23000
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.556
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.750
High resolution limit [Å]	2.690	7.320	2.700
Rmerge	0.155	0.058	0.674
Rmeas	0.168	0.064	0.730
Rpim	0.064	0.026	0.276
Number of reflections	18737	1039	920
<I/σ(I)>	5
Completeness [%]	99.7	99.1	99.7
Redundancy	6.7	6.3	6.8
CC(1/2)	0.996	0.998	0.861

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277.15	4 M Sodium Formate, pH 7.0