2C67

MAO inhibition by rasagiline analogues

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	CCD
Detector	MARRESEARCH
Spacegroup name	C 2 2 2
Unit cell lengths	131.272, 222.452, 86.225
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	15.000 - 1.700
R-factor	0.194
Rwork	0.194
R-free	0.21200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1s2q
RMSD bond length	0.007
RMSD bond angle	1.142
Data reduction software	MOSFLM
Data scaling software	SCALA
Refinement software	REFMAC (5.2.0005)

Data quality characteristics

	Overall
Low resolution limit [Å]	15.000
High resolution limit [Å]	1.700
Rmerge	0.070
Number of reflections	131493
<I/σ(I)>	12
Completeness [%]	98.2
Redundancy	3.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1