7SU9

KRAS-G12D specific TCR9a in complex with C*05-GADGVGKSL

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-11-14
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1
Spacegroup name	P 1 21 1
Unit cell lengths	72.716, 74.177, 107.389
Unit cell angles	90.00, 101.30, 90.00

Refinement procedure

Resolution	38.870 - 1.990
R-factor	0.1826
Rwork	0.181
R-free	0.21440
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6uln
RMSD bond length	0.007
RMSD bond angle	0.908
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.870	2.070
High resolution limit [Å]	1.990	1.990
Number of reflections	75462	7166
<I/σ(I)>	38.75	2.75
Completeness [%]	98.5	93.84
Redundancy	16.8
CC(1/2)	0.998	0.892

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.1	293	22% PEG 3350, 0.1 M Mops and 0.25 M MgSO4