9V99

Crystal structure of the periplasmic domain of CadF from Campylobacter jejuni in complex with a peptidoglycan peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2022-06-10
Detector	ADSC QUANTUM 270
Wavelength(s)	0.9793
Spacegroup name	P 1 21 1
Unit cell lengths	43.855, 49.226, 55.981
Unit cell angles	90.00, 112.06, 90.00

Refinement procedure

Resolution	27.390 - 1.800
R-factor	0.2082
Rwork	0.207
R-free	0.23660
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.773
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.830
High resolution limit [Å]	1.800	1.800
Number of reflections	20881	1050
<I/σ(I)>	19.1	2.1
Completeness [%]	99.6	99.2
Redundancy	3.5	3.3
CC(1/2)	0.990	0.785

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	PEG 2000, Hepes