5M61

Clathrin heavy chain N-terminal domain bound to an extended amphiphysin clathrin-box motif

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I02
Synchrotron site	Diamond
Beamline	I02
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-05-01
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.979
Spacegroup name	C 1 2 1
Unit cell lengths	138.120, 131.150, 77.830
Unit cell angles	90.00, 115.35, 90.00

Refinement procedure

Resolution	39.660 - 1.840
R-factor	0.16247
Rwork	0.161
R-free	0.18153
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1c9i
RMSD bond length	0.012
RMSD bond angle	1.549
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	REFMAC
Refinement software	REFMAC (5.8.0135)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.700	1.890
High resolution limit [Å]	1.840	1.840
Rmerge	0.084	1.232
Number of reflections	102809
<I/σ(I)>	12.8	1.5
Completeness [%]	99.9	99.5
Redundancy	6.8	6.2
CC(1/2)	0.999	0.528

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.1	293	1 uL protein:peptide mix (14 mg/mL protein, 3.4 mM peptide) plus 2 uL of 1.04 M sodium malonate pH 7.1, 0.2 M sodium perchlorate equilibrated against a 200 uL reservoir of 1.15 M sodium malonate pH 7.1