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Template proteins with similar binding site:
Click to view | Rank | CscoreLB | PDB Hit | TM-score | RMSDa | IDENa | Cov. | BS-score | Lig. Name | Download Complex | Predicted binding site residues |
| 1 | 0.74 | 1wy2A | 0.930 | 1.41 | 0.377 | 0.964 | 1.40 | ZN | Download | 290,319,333 |
| 2 | 0.72 | 3q6dA | 0.967 | 0.99 | 0.382 | 0.986 | 0.94 | CA | Download | 215,226,228,333 |
| 3 | 0.46 | 1n51A | 0.901 | 2.22 | 0.266 | 0.975 | 1.11 | III | Download | 184,198,215,226,286,290,296,297,319,331,333 |
| 4 | 0.46 | 2v3yA | 0.898 | 2.25 | 0.264 | 0.975 | 1.08 | III | Download | 198,215,286,287,290,306,319,331 |
| 5 | 0.25 | 2gz5A | 0.613 | 2.67 | 0.203 | 0.670 | 0.81 | OVA | Download | 184,198,286,287,289,296,319,321 |
| 6 | 0.08 | 1pv90 | 0.898 | 1.63 | 0.384 | 0.939 | 1.24 | III | Download | 54,96,98,100,164,165,168,171,172,175,176,180,181,185,196,197,198,285,305 |
| Click on the radio buttons to visualize predicted binding site and residues. |
(a) | CscoreLB is the confidence score of predicted binding site. CscoreLB values range in between [0-1]; where a higher score indicates a more reliable ligand-binding site prediction. |
(b) | BS-score is a measure of local similarity (sequence & structure) between template binding site and predicted binding site in the query structure. Based on large scale benchmarking analysis, we have observed that a BS-score >1 reflects a significant local match between the predicted and template binding site.
| (c) | TM-score is a measure of global structural similarity between query and template protein. |
(d) | RMSDa the RMSD between residues that are structurally aligned by TM-align. |
(e) | IDENa is the percentage sequence identity in the structurally aligned region. |
(f) | Cov. represents the coverage of global structural alignment and is equal to the number of structurally aligned residues divided by length of the query protein. |
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