5JWL

Factor Inhibiting HIF D201E in Complex with Zn, and Alpha-Ketoglutarate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X6A
Synchrotron site	NSLS
Beamline	X6A
Temperature [K]	100
Detector technology	CCD
Collection date	2013-10-03
Detector	ADSC QUANTUM 270
Wavelength(s)	1.08
Spacegroup name	P 41 21 2
Unit cell lengths	86.131, 86.131, 149.213
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.560 - 2.400
R-factor	0.1839
Rwork	0.180
R-free	0.22590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3d8c
RMSD bond length	0.016
RMSD bond angle	1.755
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.440
High resolution limit [Å]	2.400	6.510	2.400
Rmerge	0.131	0.082
Total number of observations	201011
Number of reflections	22314
<I/σ(I)>	9.2
Completeness [%]	98.2	81.4	100
Redundancy	9	7.5	9.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	0.1M Hepes, 1.6mM ammonium sulfate, 3% PEG 400