6A9U

Crystal strcture of Icp55 from Saccharomyces cerevisiae bound to apstatin inhibitor

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	RRCAT INDUS-2 BEAMLINE PX-BL21
Synchrotron site	RRCAT INDUS-2
Beamline	PX-BL21
Temperature [K]	100
Detector technology	CCD
Collection date	2015-03-05
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.97947
Spacegroup name	I 4 2 2
格子定数 [Å]	148.089, 148.089, 124.989
格子定数 [度]	90.00, 90.00, 90.00

精密化法

残基	47.758 - 2.400
R因子	0.2268
Rwork	0.225
R-free	0.26590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1a16
結合長の平均二乗偏差(RMSD) [Å]	0.004
結合角の平均二乗偏差(RMSD) [度]	0.600
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	47.760	2.490
分解能 [Å] (高)	2.400	2.400
Rmerge_l_obs	0.093	0.824
Rmeas	0.101	0.903
Rpim	0.037	0.487
独立反射数	27387	2843
<I/σ(I)>	17.5	2.4
完全性 [%]	99.9	100
冗長性	7.2	6.1
CC(1/2)	0.999	0.710

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	MICROBATCH	7	293	100mM hipis pH 7 , 28% Jagffamine ED 2003 pH7, 2mM MnCl2