8G64

Heme-bound flavodoxin FldH from Fusobacterium nucleatum

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-08-05
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.991840
Spacegroup name	P 31 2 1
Unit cell lengths	67.240, 67.240, 99.650
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.860 - 1.600
R-factor	0.1605
Rwork	0.160
R-free	0.17830
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	0.862
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	37.860	10.000	1.700
High resolution limit [Å]	1.600	5.000	1.600
Rmerge	0.063	0.038	0.787
Rmeas	0.067	0.040	0.830
Number of reflections	66287	1265	5678
<I/σ(I)>	18.49
Completeness [%]	99.6
Redundancy	9.8
CC(1/2)	0.999	0.999	0.843

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	293	0.1 M sodium citrate pH 5.5, 2 M ammonium sulphate