2IIK

Crystal Structure of human peroxisomal acetyl-CoA acyl transferase 1 (ACAA1)

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2006-07-27
Detector	RIGAKU RAXIS HTC
Spacegroup name	P 21 21 21
格子定数 [Å]	55.147, 96.845, 142.055
格子定数 [度]	90.00, 90.00, 90.00

精密化法

残基	80.060 - 2.550
R因子	0.18108
Rwork	0.179
R-free	0.22345
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2c7z
結合長の平均二乗偏差(RMSD) [Å]	0.013
結合角の平均二乗偏差(RMSD) [度]	1.402
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MLPHARE
Refinement software	REFMAC (5.2.0019)

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	80.060	2.650
分解能 [Å] (高)	2.550	2.550
Rmerge_l_obs	0.110	0.401
独立反射数	25358
<I/σ(I)>	9.65	2.17
完全性 [%]	99.0	96.2
冗長性	3.66	2.79

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION, SITTING DROP	7.5	298	0.2M Amonium Sulphate, 0.1M Hepes, 25% PEG3350., pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K