5OO7

The ENTH domain from epsin-2 in complex with phosphatidylinositol 4,5-bisphosphate (PIP2)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-06-27
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.873
Spacegroup name	P 1 21 1
Unit cell lengths	47.513, 106.280, 51.291
Unit cell angles	90.00, 98.15, 90.00

Refinement procedure

Resolution	20.000 - 1.840
R-factor	0.20615
Rwork	0.204
R-free	0.25181
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3zym
RMSD bond length	0.007
RMSD bond angle	0.986
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.000	1.880
High resolution limit [Å]	1.840	1.840
Rmerge	0.120	1.420
Rpim	0.062	0.752
Number of reflections	44311
<I/σ(I)>	8.9	1
Completeness [%]	99.5
Redundancy	4.6	4.4
CC(1/2)		0.350

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	292.15	0.2 M potassium bromide, 0.1 M Tris pH 7.5, 8% (w/v) PEG 20K, 8% (w/v) PEG 550 MME.