3QLL

Crystal Structure of RipC from Yersinia pestis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9787
Spacegroup name	P 31 2 1
Unit cell lengths	88.056, 88.056, 197.021
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	42.970 - 2.450
R-factor	0.232
Rwork	0.230
R-free	0.25600
Structure solution method	SAD
RMSD bond length	0.012
RMSD bond angle	1.199
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SOLVE
Refinement software	PHENIX (dev_886)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.850
High resolution limit [Å]	2.450	7.590	2.450
Rmerge	0.061	0.013	0.382
Number of reflections	43062
<I/σ(I)>	13.1
Completeness [%]	100.0	99.9	100
Redundancy	5.8	5.9	5.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		7.4	298	18% ETHYLENE GLYCOL, .1M TCEP HYDROCHLORIDE, pH 7.4, VAPOR DIFFUSION, HANGING DROP, temperature 298K