5C9N

Crystal structure of GEMC1 coiled-coil domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	CCD
Collection date	2012-07-03
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.8726
Spacegroup name	P 21 21 21
Unit cell lengths	50.035, 70.574, 83.055
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	53.780 - 2.200
R-factor	0.22385
Rwork	0.223
R-free	0.24876
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1uii
RMSD bond length	0.010
RMSD bond angle	1.246
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.8.0123)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	53.800	2.320
High resolution limit [Å]	2.200	2.200
Rmerge	0.070	0.871
Number of reflections	15376
<I/σ(I)>	11.8	1.5
Completeness [%]	99.5	99.8
Redundancy	3.7	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M Hepes buffer pH 7.5, 7% Ethanol, 10% 2-Methyl-2,4-pentanediol (MPD) 0.01 M Ethylene-diamine-tetra-acetic acid disodium salt dihydrate.