9D8D

Crystal structure of Vibrio cholerae NFeoB in the GMPPCP-bound form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-06-03
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97936
Spacegroup name	P 1
Unit cell lengths	53.977, 59.666, 89.432
Unit cell angles	93.59, 92.61, 113.77

Refinement procedure

Resolution	31.810 - 2.110
R-factor	0.1981
Rwork	0.196
R-free	0.24700
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.000
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.21.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	88.990	2.150
High resolution limit [Å]	2.110	2.110
Number of reflections	57054	5091
<I/σ(I)>	9.4
Completeness [%]	97.6
Redundancy	1.8
CC(1/2)	0.990	0.557

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	26 % (w/v) PEG 4000, 0.2 M ammonium acetate, 0.1 M bicine (pH 8.4), 0.010 M magnesium chloride, 0.003 M GMPPCP