7WJQ

Crystal structure of GSDMB in complex with Ipah7.8

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	2021-10-06
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	70.471, 87.584, 102.794
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.430 - 2.700
R-factor	0.2123
Rwork	0.210
R-free	0.25220
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5tj4
RMSD bond length	0.003
RMSD bond angle	0.542
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.670	2.830
High resolution limit [Å]	2.700	2.700
Rmerge	0.077
Number of reflections	17543	2254
<I/σ(I)>	22.6
Completeness [%]	97.0
Redundancy	10.7
CC(1/2)	0.999	0.967

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIQUID DIFFUSION		291.15	NaCl, HEPES sodium, PEG 8000, ammonium sulfate, 1,6-hexanediol