5N4Q

Human myelin protein P2, mutant T51P

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-09-12
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9762
Spacegroup name	P 41 21 2
Unit cell lengths	66.024, 66.024, 100.859
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.686 - 1.720
R-factor	0.1686
Rwork	0.167
R-free	0.19100
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4bvm
RMSD bond length	0.006
RMSD bond angle	0.974
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.686	1.870
High resolution limit [Å]	1.720	1.720
Rmeas	0.081	2.920
Number of reflections	44944
<I/σ(I)>	12.4	0.8
Completeness [%]	99.6	97.5
Redundancy	6.1	6.1
CC(1/2)	0.999	0.678

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	293	2.1 M DL-malic acid