9BLQ

X-ray crystal structure of Streptomyces cacaoi PolD with iron and succinate bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-G
Synchrotron site	APS
Beamline	21-ID-G
Temperature [K]	100
Detector technology	CCD
Collection date	2021-09-24
Detector	MAR CCD 300 mm
Wavelength(s)	0.97857
Spacegroup name	P 65 2 2
Unit cell lengths	58.828, 58.828, 589.086
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.310 - 2.750
R-factor	0.2321
Rwork	0.230
R-free	0.26140
Structure solution method	SAD
RMSD bond length	0.003
RMSD bond angle	0.642
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SHARP
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.820
High resolution limit [Å]	2.750	2.750
Number of reflections	17281	984
<I/σ(I)>	19.5
Completeness [%]	99.0
Redundancy	8.2
CC(1/2)	0.999	0.690

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		298	0.1 M Tris (pH 8.5), 0.2 M Li2SO4, 0.05 M sodium acetate, 15-20% (v/v) glycerol, and 22-28% (w/v) PEG 4000