9PTQ

Structure of Acb2 homolog 43 in complex with 3'cADPR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2025-02-28
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97920
Spacegroup name	P 1 21 1
Unit cell lengths	60.123, 53.668, 73.479
Unit cell angles	90.00, 110.49, 90.00

Refinement procedure

Resolution	68.830 - 1.560
R-factor	0.1717
Rwork	0.171
R-free	0.19540
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009
RMSD bond angle	1.091
Data reduction software	XDS
Data scaling software	RAPD
Phasing software	PHENIX
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	68.830	1.590
High resolution limit [Å]	1.560	1.560
Number of reflections	62049	3073
<I/σ(I)>	15.4
Completeness [%]	99.1	98.6
Redundancy	6.8
CC(1/2)	0.999	0.821

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	20% w/v PEG1500, 0.1 M HEPES, pH 7.5