7SR0

Single chain trimer HLA-A*02:01 (H98L, Y108C) with HPV.16 E7 peptide YMLDLQPET

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	93
Detector technology	PIXEL
Collection date	2020-10-07
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1
Spacegroup name	P 41 21 2
Unit cell lengths	117.713, 117.713, 261.836
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.840 - 2.540
R-factor	0.2179
Rwork	0.217
R-free	0.24230
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7sqp
RMSD bond length	0.002
RMSD bond angle	0.505
Refinement software	REFMAC (1.19.1_4122)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.630
High resolution limit [Å]	2.540	2.540
Number of reflections	59905	5425
<I/σ(I)>	26.1
Completeness [%]	97.6
Redundancy	11
CC(1/2)	0.994	0.856

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	200 mM HK2PO4, 20% PEG 3350