6R75

Crystal structure of human Ube2T E54R mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-1
Synchrotron site	ESRF
Beamline	MASSIF-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-06-14
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.966
Spacegroup name	P 21 21 21
Unit cell lengths	46.130, 46.190, 74.200
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.210 - 2.000
R-factor	0.2271
Rwork	0.225
R-free	0.26440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yh2
RMSD bond length	0.007
RMSD bond angle	1.406
Data reduction software	MOSFLM
Data scaling software	Aimless (0.7.3)
Phasing software	PHASER
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.190	46.190	2.050
High resolution limit [Å]	2.000	8.940	2.000
Rmerge	0.045	0.036	0.100
Rmeas	0.053	0.042	0.115
Rpim	0.028	0.021	0.056
Total number of observations	34140
Number of reflections	9878	137	769
<I/σ(I)>	16.7
Completeness [%]	88.7	87.5	94.6
Redundancy	3.5	3.5	3.6
CC(1/2)	0.997	0.999	0.988

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.1 M Tris-HCl pH 8.5, 20% v/v glycerol ethoxylate, 3% v/v poly(ethylene imine)