4PR5

Crystal structure of a HLA-B*35:01-HPVG-D5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2012-06-12
Detector	ADSC-Q210
Wavelength(s)	0.984
Spacegroup name	P 21 21 21
Unit cell lengths	50.640, 81.230, 109.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.286 - 1.800
R-factor	0.1806
Rwork	0.179
R-free	0.21320
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	pdb entry 2FYY
RMSD bond length	0.010
RMSD bond angle	1.097
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.7.1_743)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000		1.900
High resolution limit [Å]	1.800	10.000	1.800
Rmerge	0.066	0.017	0.447
Number of reflections	42487	285	6249
<I/σ(I)>	26.2	86.1	4.76
Completeness [%]	100.0	96	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	5.6	298	16% PEG 4000, 0.2M ammonium acetate and 0.1M Na-Citrate pH 5.6, vapor diffusion, temperature 298K