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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 | 0.07 | 3agyB | 0.404 | 3.23 | 0.184 | 0.465 | 0.23 | III | Download | 11,12,14,69,70 |
| 2 | 0.02 | 2q2g0 | 0.412 | 2.62 | 0.228 | 0.460 | 0.30 | III | Download | 7,8,11,12,13,16,66,67,69,70 |
| 3 | 0.02 | 3agyA | 0.403 | 3.15 | 0.197 | 0.462 | 0.14 | III | Download | 12,13,14,69 |
| 4 | 0.02 | 3agzA | 0.414 | 3.51 | 0.196 | 0.489 | 0.19 | III | Download | 24,25,52 |
| 5 | 0.01 | 2q3zA | 0.419 | 5.98 | 0.076 | 0.637 | 0.12 | III | Download | 62,63,70 |
| 6 | 0.01 | 3cmvB | 0.261 | 7.34 | 0.043 | 0.470 | 0.13 | ANP | Download | 11,13,15 |
| 7 | 0.01 | 3cmvA | 0.301 | 7.04 | 0.057 | 0.521 | 0.14 | ANP | Download | 9,10,11,12,14 |
| 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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