5KHY

Crystal structure of oxime-linked K6 diubiquitin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I02
Synchrotron site	Diamond
Beamline	I02
Temperature [K]	80
Detector technology	PIXEL
Collection date	2016-01-27
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979490
Spacegroup name	P 43 3 2
Unit cell lengths	103.975, 103.975, 103.975
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.790 - 3.501
R-factor	0.2947
Rwork	0.282
R-free	0.33140
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.022
RMSD bond angle	1.944
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall
Low resolution limit [Å]	30.000
High resolution limit [Å]	3.500
Number of reflections	2689
<I/σ(I)>	6.77
Completeness [%]	99.0
Redundancy	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	295	PEG 3350, Zinc acetate