Results for job id P00041
Job information:
Job id: P00041
Job name: dud_er-agonist
Job starting time: 2017-12-22/16:07:46
Job ending time: 2017-12-22/16:11:00
ligand MOL2: lig.mol2
Protein UniProt AC/ID: ESR1_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 | 1l2iA | 1.9 | -48.5 | ||
| Model 2 | 5dxpA | 1.3 | -42.3 | ||
| Model 3 | 5krfA | 1.3 | -35.2 | ||
| Model 4 | 5hyrA | 1.3 | -3.5 | ||
| 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 1l2iA (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 | -55.4 | Download | ||
| Model 2 | -42.3 | Download | ||
| Model 3 | -22.8 | Download | ||
| Model 4 | -17.4 | Download | ||
| Model 5 | -15.7 | Download | ||
| Model 6 | -14.7 | Download | ||
| Model 7 | -14.3 | Download | ||
| Model 8 | -14.0 | Download | ||
| Model 9 | -13.5 | Download | ||
| Model 10 | -12.0 | Download |
Download
Click Here to download all the results.