7EOF

Structure of CCDC25-DNA 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	2020-11-12
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9788
Spacegroup name	P 21 21 21
Unit cell lengths	74.028, 74.795, 103.618
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.177 - 2.733
R-factor	0.2312
Rwork	0.229
R-free	0.26140
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	de novo predition
RMSD bond length	0.003
RMSD bond angle	0.543
Data reduction software	HKL-3000
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.10-2155)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	3.110
High resolution limit [Å]	2.730	3.000
Rmerge	0.099	0.987
Number of reflections	13026	1182
<I/σ(I)>	19.9
Completeness [%]	100.0
Redundancy	9.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.2M MES, 10% isopropanol, pH 6.0