6BNM

Crystal Structure of the P-Rex2 PH domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	110
Detector technology	CCD
Collection date	2015-04-23
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.078
Spacegroup name	P 31 2 1
Unit cell lengths	60.105, 60.105, 86.238
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	52.050 - 1.900
R-factor	0.1928
Rwork	0.191
R-free	0.23160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5d27
RMSD bond length	0.011
RMSD bond angle	1.447
Data reduction software	HKL-2000
Data scaling software	SCALEPACK (2.5.7)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	52.050	50.000	1.930
High resolution limit [Å]	1.900	5.160	1.900
Rmerge	0.064	0.036	0.713
Rmeas	0.069	0.039	0.799
Rpim	0.024	0.014	0.350
Number of reflections	14598	788	700
<I/σ(I)>	10.1
Completeness [%]	99.0	95.3	96.8
Redundancy	7.2	7.1	4.5
CC(1/2)		0.999	0.726

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	295	0.1 M Sodium Acetate pH 5, 3.325 M Sodium Chloride