7K6Y

Structure of the PTP-like myo-inositol phosphatase from Desulfovibrio magneticus (high salt)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	CCD
Collection date	2013-11-13
Detector	RAYONIX MX-300
Wavelength(s)	0.97959
Spacegroup name	C 2 2 21
Unit cell lengths	61.530, 130.890, 137.180
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.480 - 1.750
R-factor	0.1909
Rwork	0.190
R-free	0.22660
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3f41
RMSD bond length	0.005
RMSD bond angle	0.745
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.480	1.780
High resolution limit [Å]	1.750	1.750
Number of reflections	56203	3043
<I/σ(I)>	9.3
Completeness [%]	100.0
Redundancy	5.4
CC(1/2)	0.994	0.836

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.1	293	lithium sulfate, sodium acetate, MPD