2W1D

Structure determination of Aurora Kinase in complex with 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
Detector	ADSC CCD
Spacegroup name	P 61 2 2
格子定数 [Å]	83.008, 83.008, 169.719
格子定数 [度]	90.00, 90.00, 120.00

精密化法

残基	54.850 - 2.970
R因子	0.241
Rwork	0.236
R-free	0.30800
Structure solution method	OTHER
Starting model (for MR)	NONE
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]	1.438
Refinement software	REFMAC (5.4.0069A)

Quality characteristics

	Overall
分解能 [Å] (低)	54.850
分解能 [Å] (高)	2.970
Rmerge_l_obs	0.060
独立反射数	7085
<I/σ(I)>	5.6
完全性 [%]	98.1
冗長性	4.2

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1