6BIN

HLA-DRB1 in complex with Type II collagen peptide

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	2011-10-26
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.9537
Spacegroup name	C 2 2 21
Unit cell lengths	67.350, 183.710, 77.190
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.469 - 2.500
R-factor	0.202745524869
Rwork	0.201
R-free	0.23802
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4mdi
RMSD bond length	0.003
RMSD bond angle	0.547
Data reduction software	KYLIN
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall
Low resolution limit [Å]	39.470
High resolution limit [Å]	2.500
Number of reflections	16976
<I/σ(I)>	7.56
Completeness [%]	100.0
Redundancy	2
CC(1/2)	0.983

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.3	294	22-28% PEG 3350, 0.2M Potassium Nitrate, 0.1M Bis-Tris-Propane pH 7.3