9ENI

L-amino acid oxidase 4 (HcLAAO4) from the fungus Hebeloma cylindrosporum in complex with L-glutamine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-3
Synchrotron site	ESRF
Beamline	MASSIF-3
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-02-22
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.96770
Spacegroup name	P 1 21 1
Unit cell lengths	84.710, 131.740, 107.250
Unit cell angles	90.00, 95.95, 90.00

Refinement procedure

Resolution	42.130 - 2.100
R-factor	0.173
Rwork	0.172
R-free	0.20260
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.562
Data reduction software	XDS (VERSION Jun 30, 2023 BUILT=20230630)
Data scaling software	XSCALE (VERSION Jun 30, 2023 BUILT=20230630)
Phasing software	PHASER
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.150
High resolution limit [Å]	2.100	2.100
Rmeas	0.084	1.629
Number of reflections	127166	9532
<I/σ(I)>	15.86	1.64
Completeness [%]	93.3	95
Redundancy	7.57	7.73
CC(1/2)	0.998	0.636

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.1	293	protein: 10 mg/ml; reservoir solution: 2.1 M (NH4)2SO4, 0.1 M sodium citrate, pH 7.1; drop with 1000 nl protein + 500 nl reservoir