1TDK
L-amino acid oxidase from Agkistrodon halys in complex with suicide substrate L-vinylglycine
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BSRF BEAMLINE 3W1A |
Synchrotron site | BSRF |
Beamline | 3W1A |
Temperature [K] | 300 |
Detector technology | CCD |
Spacegroup name | I 21 3 |
格子定数 [Å] | 169.360, 169.360, 169.360 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 45.260 - 2.700 |
R因子 | 0.192 |
Rwork | 0.192 |
R-free | 0.22100 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1reo |
結合長の平均二乗偏差(RMSD) [Å] | 0.007 |
結合角の平均二乗偏差(RMSD) [度] | 1.300 |
Data reduction software | AUTOMAR |
Phasing software | CNS |
Refinement software | CNS (1.1) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 50.000 | 2.750 |
分解能 [Å] (高) | 2.650 | 2.650 |
Rmerge_l_obs | 0.051 | 0.447 |
独立反射数 | 176710 | |
<I/σ(I)> | 1.1 | |
完全性 [%] | 100.0 | 100 |
冗長性 | 7.03 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 5 | 300 | pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 300K |