6KWL

Crystal structure of pSLA-1*0401(R156A) complex with FMDV-derived epitope MTAHITVPY

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2017-08-16
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97931
Spacegroup name	P 1 21 1
Unit cell lengths	49.039, 66.201, 57.032
Unit cell angles	90.00, 107.91, 90.00

Refinement procedure

Resolution	35.712 - 1.800
R-factor	0.1959
Rwork	0.193
R-free	0.24680
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3qq3
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.860
High resolution limit [Å]	1.800	1.800
Rmerge	0.064	0.137
Number of reflections	29750	29750
<I/σ(I)>	18.924	11.338
Completeness [%]	97.1	97.1
Redundancy	3.8	4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	277	0.2 M Sodium chloride, 20% w/v Polyethylene glycol 3,350