7TUG

Crystal structure of Tapasin in complex with PaSta2-Fab

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	273
Detector technology	PIXEL
Collection date	2021-06-20
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000
Spacegroup name	C 2 2 21
Unit cell lengths	101.090, 168.820, 108.660
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	54.330 - 3.900
R-factor	0.2846
Rwork	0.282
R-free	0.33190
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3f8u
RMSD bond length	0.002
RMSD bond angle	0.507
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	54.330	4.040
High resolution limit [Å]	3.900	3.900
Rmerge	0.107
Rmeas	0.127
Rpim	0.065	0.851
Number of reflections	8241	692
<I/σ(I)>	7.5	0.85
Completeness [%]	95.4	80.75
Redundancy	3.5
CC(1/2)	0.998	0.477

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	291	17% PEG 10000, 0.1M Bis-Tris, 0.1M Am Acetate