5VWD

HLA-B*57:03 presenting LTVQVARVW

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	2015-10-05
Detector	ADSC QUANTUM 315
Wavelength(s)	0.954
Spacegroup name	P 21 21 21
Unit cell lengths	50.895, 81.939, 109.783
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.914 - 1.800
R-factor	0.1727
Rwork	0.171
R-free	0.20780
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2rfx
RMSD bond length	0.003
RMSD bond angle	0.774
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.9_1690)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	31.914	1.900
High resolution limit [Å]	1.800	1.800
Rmerge	0.140
Number of reflections	43277	6224
<I/σ(I)>	10.1	2.7
Completeness [%]	99.8	99.4
Redundancy	6.6	6.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.4	298	12 -20 % PEG 4000, 0.2 M ammonium acetate and 0.1 M tri-sodium citrate pH 5.4