3S8U

Crystal structure of a 2-azido-adenine-modified RNA

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2011-05-09
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.92
Spacegroup name	P 43
格子定数 [Å]	29.570, 29.570, 76.340
格子定数 [度]	90.00, 90.00, 90.00

精密化法

残基	27.574 - 1.200
R因子	0.1445
Rwork	0.143
R-free	0.17850
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3dvz
結合長の平均二乗偏差(RMSD) [Å]	0.019
結合角の平均二乗偏差(RMSD) [度]	1.784
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	PHENIX ((phenix.refine: 1.7_650))

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	30.000	1.230
分解能 [Å] (高)	1.200	1.200
Rmerge_l_obs	0.114	0.545
独立反射数	19989
<I/σ(I)>		2.67
完全性 [%]	97.5	91.1

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION, HANGING DROP	7	293	1 volume of [3.1M (NH4)2SO4, 50mM MOPS pH7.0, 10mM MgCl2, 10mM MnCl2] + 2 volumes of [RNA in 1mM EDTA, 10mM Tris pH8.0], VAPOR DIFFUSION, HANGING DROP, temperature 293K