2C65

MAO inhibition by rasagiline analogues

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-1
Synchrotron site	ESRF
Beamline	ID14-1
Temperature [K]	100
Detector technology	CCD
Detector	ADSC CCD
Spacegroup name	C 2 2 2
Unit cell lengths	131.692, 222.363, 86.146
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	15.000 - 1.700
R-factor	0.193
Rwork	0.193
R-free	0.21000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1s2q
RMSD bond length	0.007
RMSD bond angle	1.133
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	AMoRE
Refinement software	REFMAC (5.2.0005)

Data quality characteristics

	Overall
Low resolution limit [Å]	15.000
High resolution limit [Å]	1.700
Rmerge	0.090
Number of reflections	131876
<I/σ(I)>	11
Completeness [%]	98.2
Redundancy	3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1