2GDZ

Crystal structure of 15-hydroxyprostaglandin dehydrogenase type1, complexed with NAD+

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.5418
Spacegroup name	P 41 21 2
Unit cell lengths	49.540, 49.540, 195.771
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	21.860 - 1.650
R-factor	0.17746
Rwork	0.176
R-free	0.21214
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1wmb 1iy8 1zk3
RMSD bond length	0.019
RMSD bond angle	1.627
Data reduction software	MOSFLM
Data scaling software	CCP4 ((SCALA))
Phasing software	PHASER
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	196.120	1.740
High resolution limit [Å]	1.650	1.650
Rmerge	0.077	0.688
Number of reflections	30422
<I/σ(I)>	23.9	2.5
Completeness [%]	99.6	99.6
Redundancy	11.9	7.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	298	0.1 PCB, 30% PEG 1000, pH 8.0, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K