8XG2

The structure of HLA-A/Pep14

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-07-21
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979183
Spacegroup name	P 21 21 21
Unit cell lengths	60.265, 66.795, 116.823
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.940 - 1.840
R-factor	0.1919
Rwork	0.190
R-free	0.22960
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.871
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	58.410	1.940
High resolution limit [Å]	1.840	1.840
Rpim	0.027	0.027
Number of reflections	48349	48349
<I/σ(I)>	15.9
Completeness [%]	99.9
Redundancy	9.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	277	0.1M Bis-Tris, 20%w/v Polyethylene glycol monomethyl ether 5000