6C61

MHC-independent T-cell receptor B12A

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	CCD
Collection date	2010-06-18
Detector	MAR CCD 165 mm
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	128.023, 43.630, 98.373
Unit cell angles	90.00, 125.85, 90.00

Refinement procedure

Resolution	39.720 - 2.430
R-factor	0.2053
Rwork	0.203
R-free	0.24930
RMSD bond length	0.010
RMSD bond angle	1.260
Data reduction software	SCALEIT
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	BUSTER (2.8.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.470
High resolution limit [Å]	2.430	2.430
Rmerge	0.125	0.385
Number of reflections	16078	603
<I/σ(I)>	13.6
Completeness [%]	95.0	74.8
Redundancy	6.6	3.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	25% PEG 4000, 0.1M sodium acetate, pH4.6, and 0.2M (NH4)2SO4