4Z3J

Crystal structure of the lectin domain of PapG from E. coli BI47 in space group P1

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2013-09-27
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.99986
Spacegroup name	P 1
格子定数 [Å]	50.760, 56.560, 70.940
格子定数 [度]	112.76, 102.76, 88.12

精密化法

分解能	52.068 - 2.500
R因子	0.2207
Rwork	0.219
R-free	0.24560
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1j8s
結合長の平均二乗偏差(RMSD) [Å]	0.003
結合角の平均二乗偏差(RMSD) [度]	0.853
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.8.4_1496)

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	52.068	2.590
分解能 [Å] (高)	2.500	2.500
Rmerge_l_obs	0.080	0.310
独立反射数	23326
<I/σ(I)>	8.5	2.5
完全性 [%]	95.2	95.5
冗長性	1.8

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION, SITTING DROP		277	30 % PEG2000 MME, 0.15 M KBr