9ERZ

Structure of CBL-TKBD bound to Ubiquitin-fused CBLock peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-06-26
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97949
Spacegroup name	P 1 21 1
Unit cell lengths	59.783, 87.324, 84.353
Unit cell angles	90.00, 99.39, 90.00

Refinement procedure

Resolution	60.200 - 2.020
R-factor	0.1806
Rwork	0.178
R-free	0.22910
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.768
Data reduction software	XDS
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX ((1.10_2142: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	60.245	2.050
High resolution limit [Å]	2.020	2.020
Rmerge	0.038
Number of reflections	54602	2782
<I/σ(I)>	17.1
Completeness [%]	97.2
Redundancy	3.4
CC(1/2)	0.999	0.835

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		292	0.1 M Bis-Tris Propane, pH 6.0, 0.2 M sodium fluoride, and 20% (v/v) PEG 3350