9UJR

Crystal structure of WDR5 in complex with peptide Ac-MRT-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	C 2 2 21
Unit cell lengths	77.770, 98.980, 80.110
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.580 - 2.250
R-factor	0.1768
Rwork	0.174
R-free	0.23490
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.961
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]	30.580	2.310
High resolution limit [Å]	2.250	2.250
Number of reflections	15020	1086
<I/σ(I)>	8.4
Completeness [%]	99.9
Redundancy	12.4
CC(1/2)	0.995	0.589

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.1 M HEPES pH 7.0, 30% v/v Jeffamine ED-2001 pH 7.0