9QDX

GID4 in complex with Compound 1

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-10-09
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1.03318
Spacegroup name	P 1 21 1
Unit cell lengths	38.107, 40.568, 51.585
Unit cell angles	90.00, 107.94, 90.00

Refinement procedure

Resolution	49.080 - 2.260
R-factor	0.21591
Rwork	0.212
R-free	0.29566
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	1.220
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.8.0419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.080	2.350
High resolution limit [Å]	2.260	2.260
Rmerge	0.108	0.638
Number of reflections	7111	695
<I/σ(I)>	5.26
Completeness [%]	99.6
Redundancy	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M Tris pH 8.5, 25% w/v Polyethylene glycol 3,350