6GFY

pVHL:EloB:EloC in complex with modified VH032 containing (3R,4S)-3-fluoro-4-hydroxyproline (ligand 14a)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-08-02
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9282
Spacegroup name	P 41 2 2
Unit cell lengths	94.115, 94.115, 367.972
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.360 - 2.700
R-factor	0.2022
Rwork	0.199
R-free	0.25840
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5nvv
RMSD bond length	0.007
RMSD bond angle	1.176
Data reduction software	XDS
Data scaling software	Aimless (0.3.11)
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	49.360	49.360	2.790
High resolution limit [Å]	2.700	10.460	2.700
Rmerge	0.149	0.053	0.760
Rmeas	0.159	0.057	0.813
Rpim	0.054	0.021	0.285
Number of reflections	46704	969	4440
<I/σ(I)>	8.2
Completeness [%]	99.9	99.2	99.8
Redundancy	8.7	7.1	8
CC(1/2)	0.997	0.998	0.815

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.4	291	PEG 3350, MgOAc, Sodium cacodylate, DTT