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Crystal structure of Yeast Clathrin Heavy Chain N-terminal domain bound to APL2/AP-1 Beta peptide (LLDL)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	196
Detector technology	PIXEL
Collection date	2020-05-20
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.9763
Spacegroup name	P 41 21 2
Unit cell lengths	141.780, 141.780, 168.587
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	100.250 - 2.750
R-factor	0.2304
Rwork	0.229
R-free	0.25850
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.920
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	141.780	2.850
High resolution limit [Å]	2.750	2.750
Rmerge	0.080	2.879
Rmeas	0.083	2.992
Rpim	0.022	0.785
Number of reflections	45340	4359
<I/σ(I)>	30	1.6
Completeness [%]	100.0	100
Redundancy	13.1	2.8
CC(1/2)	1.000	0.589

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	9	292	4M Sodium Formate