7A1L

FACTOR INHIBITING HIF-1 ALPHA IN COMPLEX WITH ZN(II) AND 3-methyl-2-oxoglutarate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-07-20
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.97934
Spacegroup name	P 41 21 2
Unit cell lengths	86.550, 86.550, 148.091
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.170 - 2.290
R-factor	0.2085
Rwork	0.208
R-free	0.22150
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1h2k
RMSD bond length	0.002
RMSD bond angle	0.481
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	74.050	2.330
High resolution limit [Å]	2.290	2.290
Rmerge	0.106	3.519
Number of reflections	48385	1252
<I/σ(I)>	18.3	1.2
Completeness [%]	99.9	98.8
Redundancy	26.1	25.8
CC(1/2)	1.000	0.533

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	277	1.6M AMMONIUM SULPHATE, 6% PEG 400, 0.1M HEPES PH 7.5