7SSH

Single chain trimer HLA-A*02:01 (Y108A) with HPV.16 E7 peptide YMLDLQPETTDLYC

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	93
Detector technology	PIXEL
Collection date	2021-08-13
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1
Spacegroup name	P 1
Unit cell lengths	117.681, 118.924, 274.991
Unit cell angles	77.60, 77.60, 89.95

Refinement procedure

Resolution	49.190 - 2.730
R-factor	0.2552
Rwork	0.253
R-free	0.29420
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7sqp
RMSD bond length	0.004
RMSD bond angle	0.524
Refinement software	PHENIX (1.19.1_4122)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.830
High resolution limit [Å]	2.730	2.730
Number of reflections	331873	28511
<I/σ(I)>	15.9	2.33
Completeness [%]	89.7
Redundancy	2.3
CC(1/2)	0.986	0.510

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	200 mM NaCl, 100 mM HEPES, pH 7.0, 1.45 M (NH4)2SO4