8Q40

Crystal structure of cA4 activated Can2 in complex with a cleaved DNA substrate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	80
Detector technology	PIXEL
Collection date	2021-11-09
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1.00
Spacegroup name	P 1 21 1
Unit cell lengths	57.696, 79.062, 94.579
Unit cell angles	90.00, 95.36, 90.00

Refinement procedure

Resolution	47.120 - 2.210
R-factor	0.1983
Rwork	0.196
R-free	0.23590
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.629
Data reduction software	XDS (20220110)
Data scaling software	autoPROC (20230726)
Phasing software	PHASER (2.7.16)
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.120	2.289
High resolution limit [Å]	2.210	2.210
Rmerge	0.068	0.759
Rmeas	0.074	0.827
Rpim	0.029	0.323
Number of reflections	37882	2076
<I/σ(I)>	16.52	2.24
Completeness [%]	88.7	48.97
Redundancy	6.4	6.2
CC(1/2)	0.999	0.867

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	293.15	50 mM Tris pH 8, 17.1% (v/v) PEG 550 MME, 4.3% (w/v) PEG 2000