8EEH

C. ammoniagenes monoamine oxidase (MAO) bound to tryptamine

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	2021-05-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.987
Spacegroup name	P 21 21 21
Unit cell lengths	63.989, 97.868, 141.607
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.870 - 1.780
R-factor	0.215
Rwork	0.214
R-free	0.24800
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.965
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]	38.870	1.844
High resolution limit [Å]	1.780	1.780
Rmerge	0.064	0.880
Rmeas	0.070	1.056
Rpim	0.028	0.572
Number of reflections	85341	8024
<I/σ(I)>	15.6	1.4
Completeness [%]	99.3	94.4
Redundancy	5.8	3
CC(1/2)	0.999	0.645

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