4P3Z

Chlamydia pneumoniae CopN (D29 construct)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2012-06-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9801
Spacegroup name	P 21 21 21
Unit cell lengths	62.700, 62.700, 85.700
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	16.288 - 1.770
R-factor	0.183
Rwork	0.180
R-free	0.23530
Structure solution method	SAD
RMSD bond length	0.009
RMSD bond angle	1.027
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.630	1.880
High resolution limit [Å]	1.770	1.770
Rmerge	0.040	0.649
Number of reflections	33431
<I/σ(I)>	19.05	2.02
Completeness [%]	99.6	97.9
Redundancy	4.3	4.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	1.6M Ammonium sulfate