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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 | 0.81 | 3ievA | 0.975 | 0.48 | 0.332 | 0.980 | 1.56 | GNP | Download | 15,16,17,18,19,20,21,34,35,36,39,40,41,64,123,124,126,154,155,156 |
| 2 | 0.07 | 3ievA | 0.975 | 0.48 | 0.332 | 0.980 | 0.87 | RQA | Download | 206,207,210,272,273,274,275,276,277,278 |
| 3 | 0.02 | 1ob5A | 0.509 | 3.48 | 0.106 | 0.595 | 1.10 | MG | Download | 19,20,61,62 |
| 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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