9LL5

Crystal structure of the Helicobacter pylori copper resistance determinant CrdA in complex with silver ions in space group P1

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	2021-06-30
Detector	ADSC QUANTUM 270
Wavelength(s)	0.9793
Spacegroup name	P 1
Unit cell lengths	42.928, 52.666, 104.112
Unit cell angles	86.50, 84.64, 66.65

Refinement procedure

Resolution	29.760 - 1.850
R-factor	0.1934
Rwork	0.191
R-free	0.23210
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.944
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	1.880
High resolution limit [Å]	1.850	1.850
Number of reflections	67686	3263
<I/σ(I)>	25.5	3.1
Completeness [%]	95.5	91.4
Redundancy	3.7	3.6
CC(1/2)	0.995	0.803

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.8	291	PEG 600, phosphate citrate