3V6L

Crystal Structure of caspase-6 inactivation mutation

Experimental procedure

Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	CCD
Collection date	2011-02-28
Detector	ADSC QUANTUM 315
Wavelength(s)	0.98
Spacegroup name	P 65 2 2
Unit cell lengths	126.350, 126.350, 165.820
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.866 - 2.200
R-factor	0.1708
Rwork	0.169
R-free	0.20160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3nr2
RMSD bond length	0.008
RMSD bond angle	1.052
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.6.1_357))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.300
High resolution limit [Å]	2.200	2.200
Number of reflections	39913
Completeness [%]	99.1	93.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.6	293	0.1M MES, 10% PEG3350, 0.2M sodium chloride, pH 6.6, VAPOR DIFFUSION, SITTING DROP, temperature 293.0K