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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 | 0.10 | 2pvo2 | 0.890 | 1.51 | 0.277 | 0.980 | 1.22 | III | Download | 28,29,30,31,32,33,36,58,73 |
| 2 | 0.08 | 1x9m1 | 0.899 | 1.08 | 0.394 | 0.971 | 1.40 | III | Download | 30,31,32,33,36,58,62,65,66,71,72,73,88,89,90,91,92,96,99,100 |
| 3 | 0.07 | 2o8v2 | 0.893 | 1.48 | 0.376 | 0.980 | 0.90 | III | Download | 31,32,33,35,72,73,74,89,90 |
| 4 | 0.06 | 1oaz2 | 0.806 | 2.00 | 0.309 | 0.951 | 0.91 | III | Download | 71,72,73,90 |
| 5 | 0.05 | 1i5gA | 0.689 | 3.16 | 0.218 | 0.931 | 1.28 | TS5 | Download | 30,31,33,71,72,73 |
| 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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