6AA1

Crystal structure of putative amino acid binding periplasmic ABC transporter protein from Candidatus Liberibacter asiaticus bound with citrate

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-03-09
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.976251
Spacegroup name	P 21 21 21
格子定数 [Å]	46.070, 86.960, 121.800
格子定数 [度]	90.00, 90.00, 90.00

精密化法

残基	70.770 - 1.860
R因子	0.18826
Rwork	0.186
R-free	0.22517
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2yln
結合長の平均二乗偏差(RMSD) [Å]	0.016
結合角の平均二乗偏差(RMSD) [度]	1.807
Data reduction software	XDS (Version June 1, 2017)
Data scaling software	autoPROC (1.1.7)
Phasing software	MoRDa (22(2018-05-05))
Refinement software	REFMAC (5.8.0218)

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	70.773	1.889
分解能 [Å] (高)	1.857	1.857
Rmerge_l_obs	0.142	1.140
Rmeas		1.213
Rpim	0.050	0.407
独立反射数	42127	2069
<I/σ(I)>	12.5	2.2
完全性 [%]	99.9	100
冗長性	8.9	8.8
CC(1/2)	0.997	0.664

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION, SITTING DROP	5.5	277	20% PEG 550, 0.1 M Sodium Citrate pH 5.0