2PMA

Structural Genomics, the crystal structure of a protein Lpg0085 with unknown function (DUF785) from Legionella pneumophila subsp. pneumophila str. Philadelphia 1.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2006-08-03
Detector	ADSC QUANTUM 315
Wavelength(s)	1.14046
Spacegroup name	P 21 21 21
Unit cell lengths	41.711, 81.855, 97.993
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.770 - 1.890
R-factor	0.18586
Rwork	0.184
R-free	0.21301
Structure solution method	MAD
RMSD bond length	0.015
RMSD bond angle	1.526
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	MLPHARE
Refinement software	REFMAC (5.2.0019)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.770	1.930
High resolution limit [Å]	1.890	1.890
Rmerge	0.045	0.234
Number of reflections	27464
<I/σ(I)>	52.7	8.2
Completeness [%]	99.7	97.5
Redundancy	7	6.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	289	20% PEG1000, 0.2M MgCl2, 0.1M Cacodylate, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K
1	VAPOR DIFFUSION, SITTING DROP	6.5	289	20% PEG1000, 0.2M MgCl2, 0.1M Cacodylate, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K
1	VAPOR DIFFUSION, SITTING DROP	6.5	289	20% PEG1000, 0.2M MgCl2, 0.1M Cacodylate, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 289K