6AH6

M500V mutant of Coronin coiled coil domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	RRCAT INDUS-2 BEAMLINE PX-BL21
Synchrotron site	RRCAT INDUS-2
Beamline	PX-BL21
Temperature [K]	100
Detector technology	CCD
Collection date	2016-09-08
Detector	MAR CCD 130 mm
Wavelength(s)	0.9795
Spacegroup name	C 1 2 1
Unit cell lengths	117.700, 49.830, 45.330
Unit cell angles	90.00, 112.51, 90.00

Refinement procedure

Resolution	18.120 - 2.500
Rwork	0.270
R-free	0.29870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5cx2
RMSD bond length	0.012
RMSD bond angle	1.341
Data reduction software	iMOSFLM (7.2.2)
Data scaling software	SCALA (3.3.22)
Phasing software	PHASER (1.8.4_1496)
Refinement software	PHENIX (1.8.4_1496)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	18.120	2.382
High resolution limit [Å]	2.300	2.300
Rmerge	0.025	0.062
Rmeas	0.035	0.088
Number of reflections	8088	834
<I/σ(I)>	18.29	9.16
Completeness [%]	94.7	99.88
Redundancy	2	2
CC(1/2)	0.998	0.990

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.6	297	Lithium sulfate, ammonium sulphate, sodium citrate 5.6