6GFX

pVHL:EloB:EloC in complex with modified HIF-1a CODD peptide containing (3R,4S)-3-fluoro-4-hydroxyproline (ligand 13a)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	CCD
Collection date	2016-12-18
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9763
Spacegroup name	P 43 21 2
Unit cell lengths	59.258, 59.258, 245.337
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	61.330 - 1.830
R-factor	0.1846
Rwork	0.183
R-free	0.21240
RMSD bond length	0.010
RMSD bond angle	1.432
Data reduction software	XDS
Data scaling software	Aimless (0.5.9)
Phasing software	REFMAC
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	61.330	1.870
High resolution limit [Å]	1.830	1.830
Rmerge	0.095	1.083
Rmeas	0.098	1.121
Rpim	0.024	0.286
Number of reflections	39987	2427
<I/σ(I)>	17.8
Completeness [%]	100.0	99.9
Redundancy	17	15.2
CC(1/2)	0.999	0.870

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	20-22% PEG MME 5000, 0.2 M ammonium sulfate, 0.1 M potassium phosphate, 10 mM DTT