9D1I

Structure of Ubiquitin bound to KLHDC3-EloB/C

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	CCD
Collection date	2022-04-27
Detector	RAYONIX MX-300
Wavelength(s)	0.97872
Spacegroup name	C 2 2 21
Unit cell lengths	114.709, 121.440, 153.142
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.290 - 2.000
R-factor	0.1677
Rwork	0.167
R-free	0.18890
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.899
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.070
High resolution limit [Å]	2.000	4.310	2.000
Rmerge	0.101	0.071	0.553
Rmeas	0.107	0.075	0.590
Rpim	0.035	0.025	0.202
Total number of observations	632350
Number of reflections	72013	7508	7041
<I/σ(I)>	4.5
Completeness [%]	99.8	99.9	98.3
Redundancy	8.8	8.9	7.5
CC(1/2)	0.984	0.987	0.903

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	10%PEG5KMME, 0.1M HEPES pH=7.0, 5% Tascsimate pH=7.0