3V19

Forestalling insulin fibrillation by insertion of a chiral clamp mechanism-based application of protein engineering to global health

Experimental procedure

実験手法	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 14-BM-C
Synchrotron site	APS
Beamline	14-BM-C
Temperature [K]	100
Detector technology	CCD
Collection date	2007-08-08
Detector	ADSC QUANTUM 315
Wavelength(s)	0.90020
Spacegroup name	H 3
格子定数 [Å]	78.301, 78.301, 36.224
格子定数 [度]	90.00, 90.00, 120.00

精密化法

残基	16.690 - 2.000
Rwork	0.208
R-free	0.26600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1rwe
結合角の平均二乗偏差(RMSD) [度]	0.008
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	CNS
Refinement software	CNS

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	16.690	2.070
分解能 [Å] (高)	2.000	2.000
Rmerge_l_obs	0.047	0.315
独立反射数	5515
<I/σ(I)>	43.5	6.57
完全性 [%]	98.4	100
冗長性	5.2	5.1

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1	VAPOR DIFFUSION	8	298	0.02 M Tris, 0.05 M sodium citrate, 5% acetone, 0.03% phenol, 0.01% zinc acetate, pH 8.0, VAPOR DIFFUSION, temperature 298K