8EMJ

Crystal structure of HLA-B*35:01-NP9 epitope from 2006 H1N1 influenza strain

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	2019-03-06
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9537
Spacegroup name	P 21 21 21
Unit cell lengths	50.919, 81.737, 109.417
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.797 - 1.750
R-factor	0.173853733974
Rwork	0.172
R-free	0.21357
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3lks
RMSD bond length	0.013
RMSD bond angle	1.519
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	BUSTER

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	24.800	1.810
High resolution limit [Å]	1.750	1.750
Rmeas	0.042	0.326
Number of reflections	46767	4567
<I/σ(I)>	17.8	3.5
Completeness [%]	100.0
Redundancy	2
CC(1/2)	0.999	0.888

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		297	PEG, Acetate