9DNR

Structure of UBR2-RWF complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	77
Detector technology	PIXEL
Collection date	2022-11-08
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97648
Spacegroup name	P 1 21 1
Unit cell lengths	29.235, 36.957, 29.615
Unit cell angles	90.00, 109.56, 90.00

Refinement procedure

Resolution	27.910 - 1.220
R-factor	0.1682
Rwork	0.168
R-free	0.17990
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.955
Data reduction software	DIALS
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.240
High resolution limit [Å]	1.220	3.310	1.220
Rmerge	0.070	0.037	0.173
Rmeas	0.079	0.042	0.197
Rpim	0.037	0.020	0.093
Total number of observations	71322
Number of reflections	17252	879	718
<I/σ(I)>	23.2
Completeness [%]	96.4	94.6	81.2
Redundancy	4.1	4.1	3.8
CC(1/2)	0.994	0.997	0.951

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.3	293.15	For UBR2UBR-RWF co-crystal, the ligand to protein molar ratio is 1:5 and the reservoir contains 0.1 M Bis-Tris pH6.3 with 29% PEG 3350. The stock concentration of UBR2UBR for co-crystallization is 6.2 mg/ml.