9W6A

Crystal structure of 18-3 TCR in complex with HLA-A*11:01 bound to HPV16-E6(93-101)

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	2023-06-08
Detector	STFC Large Pixel Detector
Wavelength(s)	0.97918
Spacegroup name	C 1 2 1
Unit cell lengths	138.939, 65.266, 130.709
Unit cell angles	90.00, 118.79, 90.00

Refinement procedure

Resolution	45.450 - 2.350
R-factor	0.1973
Rwork	0.195
R-free	0.23790
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.471
Data scaling software	XDS
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	56.920	2.290
High resolution limit [Å]	2.230	2.230
Number of reflections	337751	24951
<I/σ(I)>	7.6
Completeness [%]	100.0
Redundancy	9.3
CC(1/2)	0.992	0.351

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2 M Potassium citrate tribasic monohydrate,20% w/v PEG 3350