1SL7
Crystal structure of calcium-loaded apo-obelin from Obelia longissima
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2003-03-20 |
Detector | MAR CCD 165 mm |
Wavelength(s) | 0.97 |
Spacegroup name | P 41 21 2 |
格子定数 [Å] | 58.641, 58.641, 110.378 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 51.990 - 2.200 |
R因子 | 0.18856 |
Rwork | 0.186 |
R-free | 0.23938 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1jf2 |
結合長の平均二乗偏差(RMSD) [Å] | 0.014 |
結合角の平均二乗偏差(RMSD) [度] | 1.307 |
Data reduction software | HKL-2000 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1.24) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 50.000 | 2.280 |
分解能 [Å] (高) | 2.200 | 2.200 |
Rmerge_l_obs | 0.074 | 0.251 |
独立反射数 | 18694 | |
<I/σ(I)> | 20.4 | 4.7 |
完全性 [%] | 99.4 | |
冗長性 | 5.9 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | modified microbatch | 7.5 | 277 | 20% w/v polyethylene glycol 10000, 0.1M HEPES, pH 7.5, modified microbatch, temperature 277K |