5UM3

Crystal structure of the V122L mutant of human UBR-box domain from UBR2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE A1
Synchrotron site	CHESS
Beamline	A1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-12-08
Detector	ADSC QUANTUM 270
Wavelength(s)	0.6263
Spacegroup name	P 21 21 21
Unit cell lengths	29.177, 29.375, 66.052
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	17.618 - 1.198
R-factor	0.139
Rwork	0.137
R-free	0.15830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5tdd
RMSD bond length	0.006
RMSD bond angle	0.953
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	17.620	1.241
High resolution limit [Å]	1.198	1.198
Rmerge	0.099	0.546
Rpim	0.039	0.328
Number of reflections	18167	1580
<I/σ(I)>	17.87	1.61
Completeness [%]	98.1	86.43
Redundancy	7	3.1
CC(1/2)	0.992	0.747

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	0.1 M HEPES pH 7.5 25% PEG 4000