1GOS

Human Monoamine Oxidase B

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-3
Synchrotron site	ESRF
Beamline	ID14-3
Temperature [K]	100
Detector technology	CCD
Spacegroup name	C 2 2 2
Unit cell lengths	138.800, 224.300, 87.200
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.000 - 3.000
R-factor	0.23
Rwork	0.229
R-free	0.27100
Structure solution method	SIR
RMSD bond length	0.016 *
RMSD bond angle	2.300 *
Data reduction software	MOSFLM
Data scaling software	SCALA
Refinement software	REFMAC

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000
High resolution limit [Å]	3.000
Rmerge	0.128	0.338 *
Number of reflections	24034
Completeness [%]	95.3	94.6 *
Redundancy	8.1	6.6 *

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Vapor diffusion *	6.5	4 *	pH 6.50

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	drop	protein	2 (mg/ml)
2	1	drop	potassium phosphate	25 (mM)	pH7.5
3	1	drop	Zwittergent	8.5 (mM)
4	1	reservoir	PEG4000	12 (%(w/v))
5	1	reservoir	ADA	100 (mM)	pH6.5
6	1	reservoir	lithium sulfate	70 (mM)