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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 | 0.01 | 1mq80 | 0.315 | 3.89 | 0.114 | 0.383 | 0.81 | III | complex1.pdb.gz | 52,53,80,82,84,86,95 |
| 2 | 0.01 | 2j8o0 | 0.279 | 4.75 | 0.078 | 0.366 | 0.40 | III | complex2.pdb.gz | 29,30,33,34,38,67,186 |
| 3 | 0.01 | 3go1L | 0.267 | 5.18 | 0.107 | 0.369 | 0.41 | III | complex3.pdb.gz | 52,53,58,84,85,96,98 |
| 4 | 0.01 | 2b1hL | 0.259 | 4.70 | 0.088 | 0.332 | 0.56 | III | complex4.pdb.gz | 57,81,83,85,97 |
| | 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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