5YBR

Fe(II)/(alpha)ketoglutarate-dependent dioxygenase PrhA-V150L/A232S in complex with preaustinoid A3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	95
Detector technology	PIXEL
Collection date	2016-12-09
Detector	DECTRIS EIGER X 4M
Wavelength(s)	1.1
Spacegroup name	P 62
Unit cell lengths	171.382, 171.382, 45.696
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	43.673 - 2.261
R-factor	0.2142
Rwork	0.212
R-free	0.25900
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ybm
RMSD bond length	0.008
RMSD bond angle	1.058
Data scaling software	Aimless
Phasing software	PHENIX ((1.10.1_2155))
Refinement software	PHENIX ((1.10.1_2155))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	44.000	2.330
High resolution limit [Å]	2.250	2.260
Number of reflections	36169
<I/σ(I)>	14.3
Completeness [%]	99.4
Redundancy	5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG 3350, lithium citrate