6MPN

Racemic M2-TM I42E crystallized from racemic detergent

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2016-06-24
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.97872
Spacegroup name	P -1
Unit cell lengths	14.680, 37.250, 43.220
Unit cell angles	107.41, 96.73, 97.66

Refinement procedure

Resolution	18.335 - 1.400
R-factor	0.2306
Rwork	0.230
R-free	0.23700
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.13_2998)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	18.335	1.450
High resolution limit [Å]	1.400	1.400
Rmeas	0.077	0.751
Rpim	0.039	0.390
Number of reflections	14625	746
<I/σ(I)>	10.08	1.81
Completeness [%]	86.8	43.45
Redundancy	3.8	3.6
CC(1/2)	0.998	0.839

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	295	0.8 M imidazole