9LJY

Crystal Structure of the Heterodimeric HIF-2 Complex with Agonist SD-14

This is a non-PDB format compatible entry.

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	2024-01-26
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97853
Spacegroup name	P 1 21 1
Unit cell lengths	49.244, 98.650, 76.975
Unit cell angles	90.00, 106.92, 90.00

Refinement procedure

Resolution	26.800 - 3.200
R-factor	0.2289
Rwork	0.228
R-free	0.24760
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.449
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	49.325	8.670	3.260
High resolution limit [Å]	3.167	6.890	3.200
Rmerge	0.124	0.059	0.666
Rmeas	0.137	0.066	0.733
Rpim	0.058	0.029	0.301
Number of reflections	11955	606	624
<I/σ(I)>	7.1
Completeness [%]	99.7	99.7	100
Redundancy	5.9	5.5	6.1
CC(1/2)	0.986	0.990	0.849

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		289	PEG 3350, Succinic Acid pH 7.0