7MNC

PTP1B L204A

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	2018-06-26
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	P 32 2 1
Unit cell lengths	87.671, 87.671, 71.176
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.960 - 1.850
R-factor	0.1753
Rwork	0.174
R-free	0.20360
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5k9v
RMSD bond length	0.009
RMSD bond angle	1.040
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX (1.18.2_3874)
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.960	1.890
High resolution limit [Å]	1.850	1.850
Rmerge	0.088	0.646
Number of reflections	26686	1386
<I/σ(I)>	17	4.5
Completeness [%]	97.4
Redundancy	11.1
CC(1/2)	0.994	0.666

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.2 M MgCl2, 0.1 M Tris pH 8, 16% PEG 8000