3OM8

The crystal structure of a hydrolase from Pseudomonas aeruginosa PA01

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2010-08-25
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97924
Spacegroup name	P 41 21 2
Unit cell lengths	91.529, 91.529, 283.745
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.231 - 2.250
R-factor	0.1937
Rwork	0.192
R-free	0.22280
Structure solution method	MAD
RMSD bond length	0.006
RMSD bond angle	0.977
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	SHELXD
Refinement software	PHENIX ((phenix.refine: 1.5_2))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.500	2.290
High resolution limit [Å]	2.250	2.250
Rmerge	0.131	0.677
Number of reflections	56314
<I/σ(I)>	21.1	2
Completeness [%]	96.3	84.7
Redundancy	9	8.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	289	0.2M proline, 0.1M HEPES, 10% w/v PEG3350, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K