1V79

Crystal structures of adenosine deaminase complexed with potent inhibitors

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL24XU
Synchrotron site	SPring-8
Beamline	BL24XU
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2003-10-25
Detector	RIGAKU RAXIS
Wavelength(s)	0.8266
Spacegroup name	P 43 21 2
Unit cell lengths	77.230, 77.230, 135.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	12.000 - 2.500
R-factor	0.256
Rwork	0.252
R-free	0.28100
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	crystal (clear)
Data scaling software	CrystalClear ((MSC/RIGAKU))
Phasing software	AMoRE
Refinement software	CNX

Data quality characteristics

	Overall
Low resolution limit [Å]	12.000
High resolution limit [Å]	2.500
Number of reflections	13950
Completeness [%]	95.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	Ammonium sulphate, PEG400, MES buffer, pH 6.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K