8SFG

Crystal Structure of the Open Unbound Catalytically Inactive Makes Caterpillars Floppy-like (MCF) Effector from Vibrio vulnificus CMCP6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-G
Synchrotron site	APS
Beamline	21-ID-G
Temperature [K]	100
Detector technology	CCD
Collection date	2019-10-17
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.97856
Spacegroup name	P 1 21 1
Unit cell lengths	61.381, 160.661, 71.793
Unit cell angles	90.00, 101.28, 90.00

Refinement procedure

Resolution	29.870 - 2.800
R-factor	0.1914
Rwork	0.189
R-free	0.22960
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	1.203
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0257)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.850
High resolution limit [Å]	2.800	2.800
Rmerge	0.110	0.751
Rmeas	0.125	0.857
Rpim	0.059	0.411
Number of reflections	32763	1579
<I/σ(I)>	13.3	1.9
Completeness [%]	97.7	94.7
Redundancy	4.4	4.3
CC(1/2)		0.627

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.3	292	Protein: 8.4 mg/ml, 0.5 Sodium chloride, 0.01M Tris pH 8.3; Screen: AmSO4 Suite (B3), 0.2M Cesium sulfate, 2.2M Ammonium sulfate. Cryo: 1.8M Ammonim sulfate, 25% Succrose