2FNT
Crystal structure of a drug-resistant (V82A) inactive (D25N) HIV-1 protease complexed with AP2V variant of HIV-1 NC-p1 substrate.
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 200 |
Detector technology | CCD |
Collection date | 2003-06-27 |
Wavelength(s) | 1.0 |
Spacegroup name | P 21 21 21 |
格子定数 [Å] | 51.056, 57.623, 61.475 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 41.880 - 1.440 |
R因子 | 0.18829 |
Rwork | 0.187 |
R-free | 0.21370 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1t3r |
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] | 1.320 |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.2.0005) |
Quality characteristics
Overall | |
分解能 [Å] (低) | 50.000 |
分解能 [Å] (高) | 1.440 |
Rmerge_l_obs | 0.047 |
独立反射数 | 33155 |
<I/σ(I)> | 10.4 |
完全性 [%] | 100.0 |
冗長性 | 9 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 6.2 | 298 | 126mM Sodium phosphate pH 6.2; 63mM sodium citrate; ammonium sulphate, VAPOR DIFFUSION, HANGING DROP, temperature 298K |