Results for job id P00083
Job information:
Job id: P00083
Job name: dud_cox2
Job starting time: 2017-12-25/08:05:23
Job ending time: 2017-12-25/08:22:27
ligand MOL2: lig.mol2
Protein UniProt AC/ID: PGH2_MOUSE
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 | 3ln1A | 1.7 | -66.9 | ||
| Model 2 | 4fm5A | 1.2 | -12.1 | ||
| Model 3 | 4fm5A | 1.2 | 32.3 | ||
| Model 4 | N/A | N/A | N/A | ||
| Model 5 | N/A | N/A | N/A | ||
| Model 6 | N/A | N/A | N/A | ||
| Model 7 | N/A | N/A | N/A | ||
| Model 8 | N/A | N/A | N/A | ||
| Model 9 | N/A | N/A | N/A | ||
| Model 10 | N/A | N/A | N/A |
Download
Click Here to download all the results.
Top 10 predicted binding modes (docking-based)
The PDB 5jw1A (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 | -71.5 | Download | ||
| Model 2 | -65.2 | Download | ||
| Model 3 | -57.9 | Download | ||
| Model 4 | -53.5 | Download | ||
| Model 5 | -49.9 | Download | ||
| Model 6 | -42.2 | Download | ||
| Model 7 | -40.8 | Download | ||
| Model 8 | -40.3 | Download | ||
| Model 9 | -40.0 | Download | ||
| Model 10 | -37.3 | Download |
Download
Click Here to download all the results.