7U6L

Pseudooxynicotine amine oxidase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2021-03-03
Detector	RAYONIX MX300-HS
Wavelength(s)	0.978
Spacegroup name	P 1 21 1
Unit cell lengths	143.990, 50.340, 150.890
Unit cell angles	90.00, 107.90, 90.00

Refinement procedure

Resolution	47.990 - 2.600
R-factor	0.1717
Rwork	0.170
R-free	0.21960
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6c71
RMSD bond length	0.004
RMSD bond angle	0.745
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.000	2.660
High resolution limit [Å]	2.600	2.600
Number of reflections	64436
<I/σ(I)>	8.3
Completeness [%]	100.0	98.4
Redundancy	3.8
CC(1/2)	0.989	0.982

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	Crystal condition: 0.18M Potassium Bromide + 29% PEG 4000 + 0.1M TAPS pH 9