7WZS

Crystal structure of Chromobacterium violaceum effector CopC in complex with host calmodulin and caspase-7

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	93
Detector technology	PIXEL
Collection date	2021-01-22
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97853
Spacegroup name	P 43 21 2
Unit cell lengths	90.871, 90.871, 426.106
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.650 - 3.600
R-factor	0.2779
Rwork	0.274
R-free	0.31370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1k88
RMSD bond length	0.001
RMSD bond angle	0.352
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.650	3.690
High resolution limit [Å]	3.600	3.600
Rmerge	0.066	1.120
Number of reflections	21855	1562
<I/σ(I)>	18.5	2.1
Completeness [%]	99.9	99.7
Redundancy	8.3	8
CC(1/2)	0.999	0.838

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	100 mM Bis-Tris propane pH 7.5, 1.5 M lithium sulfate