9HGG

SETD2 peptide bound to SPOP MATH domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-02-28
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.9537
Spacegroup name	P 2 21 21
Unit cell lengths	44.565, 51.043, 54.901
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.560 - 1.900
R-factor	0.1973
Rwork	0.194
R-free	0.25610
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.012
RMSD bond angle	1.212
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.560	1.970
High resolution limit [Å]	1.900	1.900
Number of reflections	10343	1018
<I/σ(I)>	45.9
Completeness [%]	100.0
Redundancy	12.8
CC(1/2)	0.990	0.850

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	10% w/v PEG 20 000, 20% v/v PEG MME 550, 0.03 M sodium fluoride, 0.03 M sodium bromide, 0.1 M MES/imidazole pH 6.5