9JRQ

Pilin PilA from Burkholderia thailandensis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2022-12-17
Detector	RAYONIX MX-300
Wavelength(s)	0.97872
Spacegroup name	P 1 21 1
Unit cell lengths	32.160, 52.810, 73.030
Unit cell angles	90.00, 97.81, 90.00

Refinement procedure

Resolution	29.850 - 1.250
R-factor	0.1558
Rwork	0.154
R-free	0.18730
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.006
RMSD bond angle	0.867
Data reduction software	MOSFLM (7.4.0)
Data scaling software	Aimless (0.7.9)
Phasing software	PHENIX (1.20.1_4487)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.850	1.270
High resolution limit [Å]	1.250	1.250
Rmerge	0.056	0.616
Rmeas	0.061	0.680
Rpim	0.022	0.283
Number of reflections	66592	3198
<I/σ(I)>	15.5	2.5
Completeness [%]	99.4	94.3
Redundancy	7.4	5.6
CC(1/2)	0.999	0.825

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	298	100 mM HEPES, 1.8 M ammonium sulfate