5C0E

HLA-A02 carrying YLGGPDFPTI

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I02
Synchrotron site	Diamond
Beamline	I02
Temperature [K]	100
Detector technology	PIXEL
Collection date	2011-01-29
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9763
Spacegroup name	P 1 21 1
Unit cell lengths	56.070, 79.740, 57.000
Unit cell angles	90.00, 115.74, 90.00

Refinement procedure

Resolution	31.290 - 1.491
R-factor	0.157
Rwork	0.156
R-free	0.17860
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3utq
RMSD bond length	0.021
RMSD bond angle	2.359
Data reduction software	XDS
Data scaling software	SCALA (3.3.15)
Phasing software	PHASER (2.1.4)
Refinement software	REFMAC (5.8.0073)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	31.294	31.294	1.530
High resolution limit [Å]	1.490	6.670	1.490
Rmerge		0.032	1.074
Rmeas	0.113
Rpim	0.055	0.025	0.617
Total number of observations	285952	2977	21112
Number of reflections	72820
<I/σ(I)>	12.2	30.6	2.3
Completeness [%]	99.0	94.8	98.4
Redundancy	3.9	3.6	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.1M TRIS pH8, 25% PEG 4000, 15% glycerol