6DE6

2.1 A resolution structure of histamine dehydrogenase from Rhizobium sp. 4-9

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	2018-03-04
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	103.223, 105.314, 140.038
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.427 - 2.100
R-factor	0.166
Rwork	0.164
R-free	0.20220
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3k30
Data reduction software	XDS
Data scaling software	Aimless (0.6.2)
Phasing software	PHASER (2.8.2)
Refinement software	PHENIX

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.430	2.140
High resolution limit [Å]	2.100	2.100
Rmerge	0.106	1.222
Rmeas	0.115	1.329
Rpim	0.045	0.519
Total number of observations	586744
Number of reflections	89613	4554
<I/σ(I)>	12.7
Completeness [%]	100.0	99.9
Redundancy	6.5	6.5
CC(1/2)	0.998	0.640

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	298	0.1M Na HEPES, 18% w/v PEG 12000