2HHL

Crystal structure of the human small CTD phosphatase 3 isoform 1

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X6A
Synchrotron site	NSLS
Beamline	X6A
Temperature [K]	100
Detector technology	CCD
Collection date	2006-06-21
Detector	ADSC QUANTUM 4
Wavelength(s)	1.74
Spacegroup name	P 1 21 1
格子定数 [Å]	47.419, 49.857, 179.747
格子定数 [度]	90.00, 96.90, 90.00

精密化法

残基	19.860 - 2.100
R因子	0.191
Rwork	0.188
R-free	0.25200
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ta0
結合長の平均二乗偏差(RMSD) [Å]	0.022
結合角の平均二乗偏差(RMSD) [度]	3.199
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	REFMAC (5.2.0005)

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	20.000	2.180
分解能 [Å] (高)	2.100	2.100
Rmerge_l_obs	0.056	0.265
独立反射数	47666
<I/σ(I)>	8.5
完全性 [%]	87.7	74
冗長性	1.7	1.4

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION, SITTING DROP	5.5	295	0.2M lithium sulfate monohydrate, 0.1M bis-tris, 25% w/v PEG 3350, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 295K