1JMZ

crystal structure of a quinohemoprotein amine dehydrogenase from pseudomonas putida with inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-18B
Synchrotron site	Photon Factory
Beamline	BL-18B
Temperature [K]	90
Detector technology	CCD
Collection date	2001-04-25
Detector	ADSC QUANTUM 4
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	167.210, 92.370, 79.300
Unit cell angles	90.00, 112.00, 90.00

Refinement procedure

Resolution	10.000 * - 2.000
R-factor	0.211 *
Rwork	0.215
R-free	0.25000 *
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.009 *
RMSD bond angle	1.638
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	X-PLOR
Refinement software	X-PLOR (3.851)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.000	2.090
High resolution limit [Å]	2.000	2.000
Rmerge	0.067 *	0.259 *
Number of reflections	75744
Completeness [%]	99.7 *	99.7 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		20 *	PEG MME2000, nickel chloride, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	12 (mg/ml)
2	1	reservoir	PEG2000 MME	18 (%(w/v))
3	1	reservoir		50 (mM)