1QSE

STRUCTURE OF HUMAN A6-TCR BOUND TO HLA-A2 COMPLEXED WITH ALTERED HTLV-1 TAX PEPTIDE V7R

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	ELLIOTT GX-13
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	1997-11-25
Detector	MARRESEARCH
Spacegroup name	C 1 2 1
Unit cell lengths	224.862, 48.891, 94.456
Unit cell angles	90.00, 90.49, 90.00

Refinement procedure

Resolution	25.000 - 2.800
Rwork	0.243
R-free	0.29000
RMSD bond length	0.080 *
RMSD bond angle	1.500 *
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	AMoRE
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	2.900
High resolution limit [Å]	2.800	2.800
Rmerge	0.071	0.530
Number of reflections	23577
<I/σ(I)>	12.2
Completeness [%]	91.6 *	60.8 *
Redundancy	2.1	1.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	unknown *	6.5 *	290	seeding with hanging drop vapor diffusion; 50 mM MOPS, pH 7.0, 75 mM MgSO4 and 13% PEG 8000, VAPOR DIFFUSION, HANGING DROP, temperature 290K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	protein	12 (mg/ml)
2	1	1	HLA-A2/peptide complexes
3	1	1	MES	10 (mM)
4	1	1		50 (mM)
5	1	1	EDTA	0.5 (mM)