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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 | 0.06 | 3izvK | 0.789 | 2.78 | 0.375 | 0.981 | 0.32 | RQA | Download | 130,131,132,143,144,145,148,152 |
| 2 | 0.01 | 1mhy3 | 0.304 | 5.26 | 0.019 | 0.510 | 0.16 | III | Download | 131,132,133,135,136,139,147 |
| 3 | 0.01 | 2o5j6 | 0.304 | 3.70 | 0.059 | 0.419 | 0.30 | III | Download | 20,21,22,24,25,28,33,39,61,62,66,67,68 |
| 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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