Results for job id P00039
Job information:
Job id: P00039
Job name: dud_ace
Job starting time: 2017-12-22/15:13:31
Job ending time: 2017-12-22/15:35:39
ligand MOL2: lig.mol2
Protein UniProt AC/ID: ACE_HUMAN
Top (up to) 10 predicted binding modes using SHAFTS (template-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 | 1uzeA | 1.2 | -66.2 | ||
| Model 2 | 1o86A | 1.7 | -64.1 | ||
| Model 3 | 2c6nA | 1.5 | -61.5 | ||
| Model 4 | 1uzeA | 1.3 | -10.1 | ||
| Model 5 | 1uzeA | 1.2 | -7.9 | ||
| Model 6 | 2c6nA | 1.2 | -7.1 | ||
| Model 7 | 2c6nA | 1.2 | 14.4 | ||
| Model 8 | 1uzeA | 1.3 | 39.3 | ||
| Model 9 | 1o86A | 1.2 | 49.0 | ||
| Model 10 | 1o86A | 1.2 | 61.9 |
Download
Click Here to download all the results.
Top 10 predicted binding modes (docking-based)
The PDB 1o86A (SHAFTS score: 1.7) 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 | -77.3 | Download | ||
| Model 2 | -72.5 | Download | ||
| Model 3 | -68.0 | Download | ||
| Model 4 | -67.6 | Download | ||
| Model 5 | -67.5 | Download | ||
| Model 6 | -67.4 | Download | ||
| Model 7 | -67.3 | Download | ||
| Model 8 | -66.9 | Download | ||
| Model 9 | -66.6 | Download | ||
| Model 10 | -66.5 | Download |
Download
Click Here to download all the results.