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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 | 0.59 | 2an9B | 0.605 | 1.99 | 0.363 | 0.643 | 1.37 | GDP | Download | 37,41,44,53,72,74,81,82,101,102,103,106 |
| 2 | 0.17 | 1lvgA | 0.587 | 1.84 | 0.326 | 0.623 | 1.40 | ADP | Download | 14,15,16,17,18,19,133,137,168,169,171 |
| 3 | 0.16 | 2qorA | 0.600 | 1.93 | 0.281 | 0.636 | 1.55 | POP | Download | 14,15,16,17,18,136 |
| 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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