7MJA

HLA-A*24:02 bound to Neuroblastoma derived PHOX2B peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-B
Synchrotron site	APS
Beamline	23-ID-B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-11-09
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1
Spacegroup name	P 41 21 2
Unit cell lengths	77.211, 77.211, 174.870
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	57.875 - 1.690
R-factor	0.1754
Rwork	0.175
R-free	0.19900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3vxn
RMSD bond length	0.015
RMSD bond angle	1.228
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	87.430	1.720
High resolution limit [Å]	1.690	1.690
Rmerge	0.109	0.671
Number of reflections	60180	3045
<I/σ(I)>	18.4	4.8
Completeness [%]	100.0
Redundancy	25.7
CC(1/2)	0.990	0.960

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	0.1 M HEPES pH 7.0, 10% PEG 6000