8GXE

PTPN21 FERM PTP complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-01-25
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9785
Spacegroup name	C 2 2 21
Unit cell lengths	72.313, 228.246, 117.050
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.840 - 3.000
R-factor	0.2197
Rwork	0.217
R-free	0.26310
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2bzl
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20rc1_4392)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.840	3.107
High resolution limit [Å]	3.000	3.000
Rmerge	0.289	1.583
Rpim	0.081	0.433
Number of reflections	37344	2494
<I/σ(I)>	8.89
Completeness [%]	99.7
Redundancy	13.3
CC(1/2)	0.998	0.809

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	278	PEGMME 2000, HEPES pH 7.5