6V63

SETD3 WT in Complex with an Actin Peptide with His73 Replaced with Glutamine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-08-27
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.00000
Spacegroup name	P 1 21 1
Unit cell lengths	60.344, 175.795, 66.807
Unit cell angles	90.00, 92.37, 90.00

Refinement procedure

Resolution	36.710 - 2.020
R-factor	0.1669
Rwork	0.166
R-free	0.19880
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6mbj
RMSD bond length	0.004
RMSD bond angle	0.638
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.15.2_3472))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.710	2.090
High resolution limit [Å]	2.020	2.020
Number of reflections	84534	7028
<I/σ(I)>	12.4
Completeness [%]	92.9
Redundancy	5.7
CC(1/2)	0.990	0.485

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.6	292	0.2 M ammonium acetate, 0.1 M sodium citrate tribasic dihydrate pH 5.6 and 30% (w/v) polyethylene glycol 4000