1ZQ5

Crystal structure of human androgenic 17beta-hydroxysteroid dehydrogenase type 5 in complexed with a potent inhibitor EM1404

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X8C
Synchrotron site	NSLS
Beamline	X8C
Temperature [K]	100
Detector technology	CCD
Collection date	2001-04-18
Detector	ADSC QUANTUM 4
Wavelength(s)	0.9795
Spacegroup name	P 21 21 21
Unit cell lengths	55.347, 62.781, 95.974
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.840 - 1.300
R-factor	0.18174
Rwork	0.181
R-free	0.19731
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1xf0
RMSD bond length	0.008
RMSD bond angle	1.332
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.2)

Data quality characteristics

	Overall
Low resolution limit [Å]	29.840
High resolution limit [Å]	1.300
Number of reflections	75293
Completeness [%]	95.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1