7KK7

crystal structure of ligand-free PLEKHA7 PH domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.3.1
Synchrotron site	ALS
Beamline	8.3.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-11-04
Detector	DECTRIS PILATUS 300K
Wavelength(s)	1.1158
Spacegroup name	P 21 21 21
Unit cell lengths	57.310, 59.060, 78.470
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.190 - 2.800
R-factor	0.2171
Rwork	0.213
R-free	0.27610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7kjo
RMSD bond length	0.011
RMSD bond angle	1.784
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0257)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.200	2.950
High resolution limit [Å]	2.800	2.800
Rmerge	0.071	0.810
Number of reflections	6980	1000
<I/σ(I)>	16
Completeness [%]	100.0	100
Redundancy	6.8	7.1
CC(1/2)		0.890

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	Protein in 180 mM NaCl, 20 mM Tris pH 8, 50 mM BisTris pH 6.0, 0.7 mM TCEP was mixed with 20% PEG 3350, 0.02 mM MgCl2, 100 mM HEPES pH 7.0