4M69

Crystal structure of the mouse RIP3-MLKL complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2013-04-30
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9792
Spacegroup name	C 2 2 21
Unit cell lengths	106.443, 141.951, 107.129
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.569 - 2.497
R-factor	0.2215
Rwork	0.220
R-free	0.24600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4M66 and 4M68
RMSD bond length	0.010
RMSD bond angle	1.416
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.7.3_928))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.590
High resolution limit [Å]	2.497	2.500
Number of reflections	28489
Completeness [%]	100.0	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	291	0.1M HEPES, 0.35M (NH4)2S04, 17% PEG4000, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K