6AAP

Crystal structure of Methanosarcina mazei PylRS(Y306A/Y384F) complexed with ZaeSeCys

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B2
Synchrotron site	SPring-8
Beamline	BL26B2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-11-28
Detector	RAYONIX MX-225
Wavelength(s)	0.97916
Spacegroup name	C 1 2 1
格子定数 [Å]	100.797, 43.609, 72.478
格子定数 [度]	90.00, 119.67, 90.00

精密化法

残基	37.041 - 1.500
R因子	0.1651
Rwork	0.164
R-free	0.19620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2zim
結合長の平均二乗偏差(RMSD) [Å]	0.005
結合角の平均二乗偏差(RMSD) [度]	0.948
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	50.000	1.530
分解能 [Å] (高)	1.500	1.500
Rmeas	0.053
Rpim	0.010	0.138
独立反射数	43994	2174
<I/σ(I)>	85
完全性 [%]	99.7
冗長性	29

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION, HANGING DROP	8.5	281	Tris-HCl (pH 8.5), PEG 200, KCl, MgCl2, sodium citrate