9XGP

Acinetobacter baumannii MoaD-MoaE Complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-07-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.98
Spacegroup name	P 41 21 2
Unit cell lengths	109.445, 109.445, 121.443
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.770 - 1.960
R-factor	0.1939
Rwork	0.193
R-free	0.22110
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.948
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX ((1.19_4092: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.770	2.030
High resolution limit [Å]	1.960	1.960
Number of reflections	50348	5233
<I/σ(I)>	36.63
Completeness [%]	94.6
Redundancy	25.8
CC(1/2)	1.000	0.932

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M Sodium chloride, 0.1 M HEPES pH 7.5, and 1.6 M Ammonium sulfate