Results for job id P00026
Job information:
Job id: P00026
Job name: FXR-lig8
Job starting time: 2017-12-14/09:52:17
Job ending time: 2017-12-14/10:08:27
ligand MOL2: lig.mol2
Protein UniProt AC/ID: Q96RI1/NR1H4_HUMAN
Top (up to) 10 predicted binding modes using SHAFTS (ligand-based)
Click the "View" button on the right panel to display the corresponding binding mode.
Click "Model #" to download the corresponding PDB file.
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| Models | Active | View | PDB | SHAFTS | ITScore |
| Model 1 | 5q1hA | 1.7 | -69.4 | ||
| Model 2 | 5q1hA | 1.3 | -54.1 | ||
| Model 3 | 3okhA | 1.6 | -39.4 | ||
| Model 4 | 5q11A | 1.3 | -38.3 | ||
| Model 5 | 5q0jA | 1.3 | -35.6 | ||
| Model 6 | 3okhA | 1.3 | -30.3 | ||
| Model 7 | 5q13A | 1.2 | -29.6 | ||
| Model 8 | 3okhA | 1.3 | -27.6 | ||
| Model 9 | 5q1iA | 1.3 | 24.6 | ||
| Model 10 | 3okhA | 1.3 | 26.2 |
Download
Click Here to download all the results.
Top 10 predicted binding modes (docking-based)
The PDB 5q0lA (SHAFTS score: 1.9) was selected for docking.
Click the "View" button on the right panel to display the corresponding binding mode.
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| Models | Active | View | ITScore | Download |
| Model 1 | -58.1 | Download | ||
| Model 2 | -54.6 | Download | ||
| Model 3 | -46.7 | Download | ||
| Model 4 | -42.8 | Download | ||
| Model 5 | -39.7 | Download | ||
| Model 6 | -36.6 | Download | ||
| Model 7 | -36.0 | Download | ||
| Model 8 | -35.5 | Download | ||
| Model 9 | -34.6 | Download | ||
| Model 10 | -34.4 | Download |
Download
Click Here to download all the results.