5BZX

Crystal structure of human phosphatase PTEN treated with a bisperoxovanadium complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-09-12
Detector	PSI PILATUS 6M
Wavelength(s)	1.77119
Spacegroup name	C 2 2 21
Unit cell lengths	207.060, 206.900, 87.670
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.290 - 2.500
R-factor	0.1767
Rwork	0.175
R-free	0.20370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1d5r
RMSD bond length	0.009
RMSD bond angle	1.538
Data scaling software	XSCALE
Phasing software	PHASER (2.5.6)
Refinement software	REFMAC (5.8.0103)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.293		2.600
High resolution limit [Å]	2.500	20.000	2.500
Rmerge	0.118	0.035	1.552
Rmeas	0.123	0.037	1.619
Total number of observations	843899
Number of reflections	65393	152	7145
<I/σ(I)>	17.43	52.51	1.53
Completeness [%]	100.0	91	100
Redundancy	12.91

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	0.1 M MES pH 6.5, 1.25 M L-tartrat, 7.5% glycerol