6GLC

Structure of phospho-Parkin bound to phospho-ubiquitin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-04-22
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.96859
Spacegroup name	P 32 2 1
Unit cell lengths	83.931, 83.931, 105.119
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	59.786 - 1.800
R-factor	0.1812
Rwork	0.180
R-free	0.20540
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5n2w 5c1z
RMSD bond length	0.007
RMSD bond angle	0.863
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	72.690	1.840
High resolution limit [Å]	1.800	1.800
Rmerge	0.065	0.773
Number of reflections	40324	2339
<I/σ(I)>	13.8	2.4
Completeness [%]	100.0	99.3
Redundancy	6.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	291	12.5% (w/v) PEG 1000, 12.5% (w/v) PEG 3350, 12.5% (v/v) MPD, 0.03 M of each sodium nitrate, disodium hydrogen phosphate, ammonium sulphate, 0.1 M MOPS/HEPES-Na (pH 7.5)