2Y1W

CRYSTAL STRUCTURE OF COACTIVATOR ASSOCIATED ARGININE METHYLTRANSFERASE 1 (CARM1) IN COMPLEX WITH SINEFUNGIN AND INDOLE INHIBITOR

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Temperature [K]	100
Detector technology	CCD
Collection date	2006-09-01
Detector	ADSC QUANTUM 315r
Spacegroup name	P 21 21 2
格子定数 [Å]	74.896, 98.471, 207.184
格子定数 [度]	90.00, 90.00, 90.00

精密化法

残基	29.880 - 2.100
R因子	0.205
Rwork	0.205
R-free	0.24400
Structure solution method	MOLECULAR REPLACEMENT
結合長の平均二乗偏差(RMSD) [Å]	0.012
結合角の平均二乗偏差(RMSD) [度]	1.200
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	CNS (NULL)

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	30.000	2.180
分解能 [Å] (高)	2.100	2.100
Rmerge_l_obs	0.080	0.490
独立反射数	77014
<I/σ(I)>	14.1	1.7
完全性 [%]	85.4	30
冗長性	3.7

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1		8.5		20-30% PEG 2000K, 0.1 M TRIS-HCL PH 8.5, 0.2 M TRIMETHYLAMINE N-OXIDE DIHYDRATE.