3TVY

Structural Analysis of Adhesive Tip pilin, GBS104 from Group B Streptococcus agalactiae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2010-01-07
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.5418
Spacegroup name	P 21 21 2
Unit cell lengths	74.749, 101.290, 52.665
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.064 - 2.000
R-factor	0.21214
Rwork	0.210
R-free	0.25111
Structure solution method	SAD
RMSD bond length	0.014
RMSD bond angle	1.468
Data reduction software	d*TREK
Data scaling software	d*TREK
Phasing software	PHENIX
Refinement software	REFMAC (5.5.0109)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	35.064	2.070
High resolution limit [Å]	2.000	2.000
Rmerge	0.120	0.450
Number of reflections	27094
<I/σ(I)>	9.3	3.1
Completeness [%]	97.7	94.4
Redundancy	5.8	5.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	295	20% PEG8000, 0.1 M HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K