6FPF

Structure of the Ustilago maydis chorismate mutase 1

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-05-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.987
Spacegroup name	P 2 21 21
格子定数 [Å]	82.768, 83.478, 186.732
格子定数 [度]	90.00, 90.00, 90.00

精密化法

残基	49.740 - 2.200
R因子	0.15775
Rwork	0.155
R-free	0.20290
Structure solution method	SAD
結合長の平均二乗偏差(RMSD) [Å]	0.030
結合角の平均二乗偏差(RMSD) [度]	2.419
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0189)

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	50.010	1.963
分解能 [Å] (高)	1.895	1.895
Rmerge_l_obs	0.083	0.773
独立反射数	63072	9715
<I/σ(I)>	11.1	1.8
完全性 [%]	99.5	90.8
冗長性	6.7	6.3
CC(1/2)	0.990	0.710

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION, SITTING DROP		294	0.2 M MES pH 5.0, 20 % (v/v) PEG 6000