7P0T

CRYSTAL STRUCTURE OF THE MURINE CLASS I MAJOR HISTOCOMPATIBILITY COMPLEX H-2DB IN COMPLEX WITH LCMV-DERIVED GP33 PEPTIDE with D-AMINOACID

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ELETTRA BEAMLINE 11.2C
Synchrotron site	ELETTRA
Beamline	11.2C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-07-28
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	120.512, 124.602, 92.915
Unit cell angles	90.00, 126.87, 90.00

Refinement procedure

Resolution	48.200 - 2.605
R-factor	0.2017
Rwork	0.197
R-free	0.24400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1s7u
RMSD bond length	0.005
RMSD bond angle	0.768
Data scaling software	STARANISO
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.200	2.893
High resolution limit [Å]	2.600	2.605
Number of reflections	22227	1309
<I/σ(I)>	16.1
Completeness [%]	92.0
Redundancy	6.5
CC(1/2)	0.998	0.773

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.3	295	1.7 M Ammonium Sulphate, 100 mM Tris-HCl, pH 8.3