6IWH

Crystal structure of rhesus macaque MHC class I molecule Mamu-B*05104 complexed with C14-GGGI lipopeptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	CCD
Collection date	2017-07-23
Detector	RAYONIX MX225HE
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	55.103, 80.791, 106.421
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.400 - 1.950
Rwork	0.175
R-free	0.21700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4zfz
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.980
High resolution limit [Å]	1.950	1.950
Rmerge	0.073	0.262
Number of reflections	35329
<I/σ(I)>	46
Completeness [%]	99.8
Redundancy	8.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293.15	200mM Sodium fluoride, 100mM Bis-Tris propane, 20% PEG 3350