4HC6
Mycobacterium tuberculosis Rv2523cE77A x-ray structure solved with 1.8 angstrom resolution
Experimental procedure
実験手法 | MAD |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2008-08-13 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.89844, 0.91901, 0.91928 |
Spacegroup name | P 21 3 |
格子定数 [Å] | 73.272, 73.272, 73.272 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 19.580 - 1.800 |
R因子 | 0.17721 |
Rwork | 0.175 |
R-free | 0.21204 |
Structure solution method | MAD |
結合長の平均二乗偏差(RMSD) [Å] | 0.015 |
結合角の平均二乗偏差(RMSD) [度] | 1.469 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SOLVE |
Refinement software | REFMAC (5.5.0109) |
Quality characteristics
Overall | Outer shell | |
分解能 [Å] (低) | 50.000 | 1.830 |
分解能 [Å] (高) | 1.800 | 1.800 |
Rmerge_l_obs | 0.083 | 0.436 |
独立反射数 | 12446 | |
<I/σ(I)> | 30.5 | 4.24 |
完全性 [%] | 100.0 | 100 |
冗長性 | 7.1 | 7.2 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 4.6 | 295 | 0.1 M sodium acetate trihydrate, 2.0 M sodium chloride, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 295K |