1WM1

Crystal Structure of Prolyl Aminopeptidase, Complex with Pro-TBODA

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-6A
Synchrotron site	Photon Factory
Beamline	BL-6A
Temperature [K]	298
Detector technology	CCD
Collection date	2003-02-17
Detector	ADSC QUANTUM 4
Wavelength(s)	1.000
Spacegroup name	P 43 21 2
Unit cell lengths	65.445, 65.445, 169.071
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.100
Rwork	0.200
R-free	0.23000
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.006
RMSD bond angle	1.163
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	2.210
High resolution limit [Å]	2.100	2.100
Number of reflections	22338
<I/σ(I)>	12.6	3.2
Completeness [%]	99.9	100
Redundancy	4.1	4.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	293	PEG6000, cacodylate, sodium acetate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K