9B07

Kynurenine monooxygenase from Pseudomonas fluorescens complexed with biphenylacetyltetrazole

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-02-11
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0000
Spacegroup name	P 1 21 1
Unit cell lengths	70.050, 52.190, 135.880
Unit cell angles	90.00, 103.70, 90.00

Refinement procedure

Resolution	55.380 - 1.880
R-factor	0.1949
Rwork	0.194
R-free	0.22910
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond angle	11.686
Data reduction software	autoPROC
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	55.380	1.930
High resolution limit [Å]	1.880	1.880
Number of reflections	76842	5691
<I/σ(I)>	9.91
Completeness [%]	98.3
Redundancy	3.2
CC(1/2)	0.999	0.281

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		295	13% PEG 8000, 0.13M Ca(OAc)2, 14% glycerol, and 0.08 M sodium cacodylate, pH 6.5