7MKZ

PTP1B F225Y mutant, open state

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-01-25
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	P 32 2 1
Unit cell lengths	88.552, 88.552, 72.643
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	38.340 - 1.400
R-factor	0.1569
Rwork	0.156
R-free	0.17300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5k9v
RMSD bond length	0.014
RMSD bond angle	1.302
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.19.1_4122)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.340	1.420
High resolution limit [Å]	1.400	1.400
Rmerge	0.076	1.395
Number of reflections	64847	3034
<I/σ(I)>	14.6	1.5
Completeness [%]	99.6	96
Redundancy	10	9.4
CC(1/2)	0.999	0.660

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.1 M TRIS, PH 7.4, 0.2 M MGCL2, 16% PEG8000