7RT0

1.80 A resolution structure of MAO from P. nicotinovorans in complex with FAD

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 17-ID
Synchrotron site	APS
Beamline	17-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-20
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0000
Spacegroup name	C 1 2 1
Unit cell lengths	203.302, 51.740, 45.739
Unit cell angles	90.00, 92.57, 90.00

Refinement procedure

Resolution	45.690 - 1.800
R-factor	0.1701
Rwork	0.169
R-free	0.19330
Structure solution method	SAD
Data reduction software	XDS
Data scaling software	Aimless (0.7.7)
Phasing software	CRANK2
Refinement software	PHENIX (dev_4273)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	45.690	45.690	1.840
High resolution limit [Å]	1.800	9.000	1.800
Rmerge	0.145	0.070	1.011
Total number of observations	303398	2484	18664
Number of reflections	44295	385	2637
<I/σ(I)>	8.6	21.3	2
Completeness [%]	100.0	99	100
Redundancy	6.8	6.5	7.1
CC(1/2)	0.995	0.995	0.757

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.2	298	20% (w/v) PEG 6000, 0.1 M Bicine