4IHK

Crystal structure of the Collagen VI alpha3 N5 domain R1061Q

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-03-16
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97780
Spacegroup name	P 43 21 2
Unit cell lengths	55.070, 55.070, 106.870
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.349 - 1.200
R-factor	0.1401
Rwork	0.139
R-free	0.16610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4igi
RMSD bond length	0.008
RMSD bond angle	1.319
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8_1069))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.350	1.220
High resolution limit [Å]	1.200	1.200
Rmerge	0.040	0.490
Number of reflections	53401
<I/σ(I)>		2.2
Completeness [%]	99.7	96.6
Redundancy	6.6	3.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.2	294	0.2M sodium chloride, 0.1M phosphate/citrate, 20% PEG 8000, pH 4.2, VAPOR DIFFUSION, SITTING DROP, temperature 294K