6XVR

Human myelin protein P2 mutant L35S

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	EMBL/DESY, HAMBURG BEAMLINE X12
Synchrotron site	EMBL/DESY, HAMBURG
Beamline	X12
Temperature [K]	100
Detector technology	CCD
Collection date	2011-04-19
Detector	RAYONIX MX-225
Wavelength(s)	1.0
Spacegroup name	P 41 21 2
Unit cell lengths	65.830, 65.830, 101.320
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.000
R-factor	0.1724
Rwork	0.170
R-free	0.21290
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2wut
RMSD bond length	0.012
RMSD bond angle	1.048
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (dev_2247)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	20.000	2.050
High resolution limit [Å]	2.000	2.000
Rmeas	0.104	1.574
Number of reflections	15619	1119
<I/σ(I)>	19.8	1.7
Completeness [%]	99.8	98.2
Redundancy	12.3
CC(1/2)	0.999	0.848

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	291	3.6 M ammonium sulphate, 0.1 M HEPES pH 7.0