5JKP

Crystal structure of immunity protein Pa5087 from Pseudomonas aeruginosa

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-10-25
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.9778
Spacegroup name	P 21 21 21
Unit cell lengths	58.015, 58.686, 78.720
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.495 - 2.106
R-factor	0.1981
Rwork	0.196
R-free	0.23850
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5jjo
RMSD bond length	0.003
RMSD bond angle	0.670
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.140
High resolution limit [Å]	2.100	2.100
Rmerge	0.101	0.480
Number of reflections	16110
<I/σ(I)>	21.56	3.22
Completeness [%]	99.8	100
Redundancy	6.3	6.6
CC(1/2)	0.970

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	0.1M Calcium acetate, 0.1M MES, 15% PEG400