3HX6

Crystal structure of Pseudomonas aeruginosa PilY1 C-terminal domain

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	2007-02-10
Detector	ADSC QUANTUM 315
Wavelength(s)	0.979
Spacegroup name	P 21 21 21
Unit cell lengths	64.000, 108.000, 159.000
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.000 - 2.100
R-factor	0.213
Rwork	0.196
R-free	0.23530
Structure solution method	SAD
RMSD bond length	0.005
RMSD bond angle	1.368
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MLPHARE
Refinement software	CNS

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	2.100
Number of reflections	118348
Completeness [%]	99.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	289	0.3 M Sodium malonate pH 6.5, 20% PEG 3350, 50 mM DTT, 30-100 mM (NH4)3PO4, 4-8% Trifluoroethanol, VAPOR DIFFUSION, HANGING DROP, temperature 289K
1	VAPOR DIFFUSION, HANGING DROP	6.5	289	0.3 M Sodium malonate pH 6.5, 20% PEG 3350, 50 mM DTT, 30-100 mM (NH4)3PO4, 4-8% Trifluoroethanol, VAPOR DIFFUSION, HANGING DROP, temperature 289K