6BTK

Segment from bank vole prion protein 168-176 QYNNQNNFV

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-10-22
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9798
Spacegroup name	P 1
Unit cell lengths	4.874, 10.107, 30.415
Unit cell angles	93.36, 91.15, 101.66

Refinement procedure

Resolution	30.350 - 1.100
R-factor	0.1409
Rwork	0.139
R-free	0.16220
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER (2.6.0)
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	100.000	100.000	1.140
High resolution limit [Å]	1.100	2.370	1.100
Rmerge	0.101	0.079	0.403
Rmeas	0.142	0.112	0.570
Rpim	0.100	0.079	0.403
Total number of observations	3070
Number of reflections	1867	201	110
<I/σ(I)>	5.7
Completeness [%]	80.8	90.5	46.2
Redundancy	1.6	1.8	1.2
CC(1/2)		0.982	0.532

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	298	0.1 M MES, pH 6, 10% ethanol