6A8S

Crystal Structure of the putative amino acid-binding periplasmic ABC transporter protein from Candidatus Liberibacter asiaticus in complex with Cysteine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-11-03
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.976251
Spacegroup name	P 21 21 21
Unit cell lengths	45.791, 87.049, 122.164
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	36.885 - 2.050
R-factor	0.2001
Rwork	0.197
R-free	0.25830
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2yln
RMSD bond length	0.007
RMSD bond angle	0.886
Data reduction software	XDS (version June1, 2017)
Data scaling software	Aimless (0.5.32)
Phasing software	MoRDa (22(2018-05-05))
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	70.890	2.120
High resolution limit [Å]	2.050	2.050
Rmerge	0.147
Rmeas	0.147
Rpim	0.071	0.452
Number of reflections	31433	3028
<I/σ(I)>	8.5	2.1
Completeness [%]	99.8	99.7
Redundancy	5.2	5.3
CC(1/2)	0.994	0.702

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	277	2M Ammonium sulphate, 0.1M Sodium acetate Trihydrate