7C4L

Anncestral L-amino acid oxidase (AncLAAO-N5) L-Gln binding form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-5A
Synchrotron site	Photon Factory
Beamline	BL-5A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-12-06
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	1.0
Spacegroup name	I 4 2 2
Unit cell lengths	132.558, 132.558, 191.806
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.950 - 2.600
R-factor	0.2111
Rwork	0.208
R-free	0.27720
Structure solution method	SAD
RMSD bond length	0.008
RMSD bond angle	1.016
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	AutoSol
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.000	2.740
High resolution limit [Å]	2.600	2.600
Rmerge	0.119	0.687
Number of reflections	26591	3823
<I/σ(I)>	26.5
Completeness [%]	100.0
Redundancy	26.5
CC(1/2)	1.000	0.953

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	3.5	295	1.0M NaCl, 0.1M citric acid pH 3.5