8ONF

Crystal structure of Bdellovibrio bacteriovorus Bd2439 fibre C-terminal domains with ethylene glycol

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-06-06
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.979
Spacegroup name	P 21 21 2
Unit cell lengths	84.368, 161.278, 52.067
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.340 - 1.530
R-factor	0.1653
Rwork	0.164
R-free	0.18510
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.863
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	84.370	1.550
High resolution limit [Å]	1.530	1.530
Rmerge	0.062	0.653
Rmeas	0.073	0.842
Rpim	0.037	0.526
Total number of observations	341050	8323
Number of reflections	104740	4168
<I/σ(I)>	11.2	1.1
Completeness [%]	96.9
Redundancy	3.3	2
CC(1/2)	0.998	0.638

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.1 M Sodium chloride 0.1 M Sodium formate 0.1 M Bis-Tris propane 8.5 6.25 % w/v PEG 3350 6.25%w/v PEG 4000 6.25%w/v PEG 2000 6.25%w/v PEG 5000 MME