3N24

The crystal structure of a two-component sensor domain (3rd form) from Pseudomonas aeruginosa PA01

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 19-ID
Synchrotron site	APS
Beamline	19-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2009-11-16
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97931
Spacegroup name	P 1
格子定数 [Å]	48.003, 61.093, 71.600
格子定数 [度]	85.60, 70.47, 89.50

精密化法

残基	36.630 - 2.056
R因子	0.2064
Rwork	0.203
R-free	0.28160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3kkb
結合長の平均二乗偏差(RMSD) [Å]	0.007
結合角の平均二乗偏差(RMSD) [度]	1.022
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	MOLREP
Refinement software	PHENIX ((phenix.refine: 1.5_2))

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	37.000	2.090
分解能 [Å] (高)	2.050	2.050
Rmerge_l_obs	0.081	0.549
独立反射数	46030
<I/σ(I)>	14.4	1.54
完全性 [%]	97.2	90
冗長性	2.2	2.2

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION, SITTING DROP	4.2	293	0.2M sodium, 0.1M phosphate citrate, 20% PEG8000, pH 4.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K