7NDQ

Gag:02 TCR in complex with HLA-E.

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-02
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.9795
Spacegroup name	P 43 21 2
Unit cell lengths	89.391, 89.391, 293.298
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	76.445 - 2.551
Rwork	0.240
R-free	0.29630
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5w1w 5eu6
RMSD bond length	0.006
RMSD bond angle	1.542
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHASER (2.8.3)
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	85.354	2.590
High resolution limit [Å]	2.550	2.550
Rmerge	0.207	6.926
Rpim	0.041	1.343
Number of reflections	39941	1932
<I/σ(I)>	11.6	0.3
Completeness [%]	100.0
Redundancy	26.3
CC(1/2)	1.000	0.735

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	23.2% (w/v) PEG 1500, 93 mM MMT pH 9.0