8GVL

PTPN21 FERM

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	2020-07-16
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	41.452, 105.443, 162.302
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.960 - 2.100
R-factor	0.1943
Rwork	0.193
R-free	0.22960
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2al6
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]	27.960	2.175
High resolution limit [Å]	2.100	2.100
Rmerge	0.070	0.541
Rpim	0.028	0.222
Number of reflections	80119	2717
<I/σ(I)>	16.19	3.18
Completeness [%]	99.8
Redundancy	7.2
CC(1/2)	0.998	0.897

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		277	MPD