7B7P

PilB minor pilin from Streptococcus sanguinis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-04-07
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.976
Spacegroup name	P 61
Unit cell lengths	124.380, 124.380, 140.740
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	56.880 - 2.260
Rwork	0.205
R-free	0.23700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	SelenoMet
RMSD bond length	0.008
RMSD bond angle	0.988
Data reduction software	xia2 (3dii)
Data scaling software	xia2 (3dii)
Phasing software	PHASER
Refinement software	PHENIX (version 1.17.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	56.900	2.300
High resolution limit [Å]	2.260	2.260
Rmerge	0.062
Rmeas	0.068
Number of reflections	57372	2784
<I/σ(I)>	13.4
Completeness [%]	99.4	96.6
Redundancy	5.7
CC(1/2)	0.999	0.244

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M Bis-tris propane (pH 7.0), 3 M NaCl