8XRF

The crystal structure of AsfvTopII in complex with G-DNA

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	2023-06-20
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.987
Spacegroup name	P 21 21 2
Unit cell lengths	135.770, 126.410, 135.690
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.860 - 2.940
R-factor	0.2199
Rwork	0.218
R-free	0.26260
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.864
Data reduction software	XDS
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX ((1.19.1_4122: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	31.860	3.020
High resolution limit [Å]	2.940	2.940
Rmerge	0.234	1.245
Rmeas	0.255	1.346
Rpim	0.100	0.510
Total number of observations	327604	25249
Number of reflections	50298	3661
<I/σ(I)>	5.9	1.5
Completeness [%]	99.9
Redundancy	6.5	6.9
CC(1/2)	0.981	0.609

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298.15	40% MPD