9UK3

Crystal structure of WDR5 in complex with peptide Ac-MRTEPRPPAP-NH2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-06-23
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979
Spacegroup name	P 2 21 21
Unit cell lengths	41.072, 80.972, 84.539
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	58.480 - 1.690
R-factor	0.1699
Rwork	0.168
R-free	0.19950
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.981
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	58.480	1.790
High resolution limit [Å]	1.690	1.690
Number of reflections	31858	4615
<I/σ(I)>	17.4
Completeness [%]	99.2
Redundancy	9.7
CC(1/2)	0.999	0.948

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.1 M BIS-TRIS pH 5.5, 25% w/v Polyethylene glycol 3,350