8EEL

C. ammoniagenes monoamine oxidase (MAO) bound to 5-aminopentanol

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-07-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.977
Spacegroup name	P 21 21 21
Unit cell lengths	59.820, 118.541, 141.081
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.050 - 1.970
R-factor	0.1788
Rwork	0.178
R-free	0.21200
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.857
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.050	2.040
High resolution limit [Å]	1.970	1.970
Rmerge	0.114	0.762
Rmeas	0.116	0.781
Rpim	0.023	0.170
Number of reflections	70509	6388
<I/σ(I)>	24.7	5
Completeness [%]	98.2	89.86
Redundancy	25.4	20
CC(1/2)	0.999	0.946

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		290	10 - 15% w/v PEG-3350, 0.1 M sodium malonate, pH 5.0