6MTM

Crystal Structure of EM2 TCR in complex with HLA-B*37:01-NP338

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-10-22
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.954
Spacegroup name	P 21 21 21
Unit cell lengths	46.806, 97.915, 189.594
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.440 - 3.000
R-factor	0.223
Rwork	0.218
R-free	0.30100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3gso 1kgc
RMSD bond length	0.008
RMSD bond angle	1.030
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	BUSTER

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.400	3.160
High resolution limit [Å]	3.000	3.000
Rpim	0.134	0.391
Number of reflections	18278	2614
<I/σ(I)>	6.3
Completeness [%]	100.0
Redundancy	7.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	277	19% PEG 3350, 0.2 ammonium tartrate