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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 | 0.40 | 1p71B | 0.893 | 1.29 | 0.356 | 1.000 | 1.69 | QNA | Download | 58,59,60,61,62,63,64,69,71 |
| 2 | 0.34 | 1p78B | 0.879 | 1.39 | 0.356 | 1.000 | 0.89 | QNA | Download | 53,55,56,59,61,68 |
| 3 | 0.24 | 1p51B | 0.881 | 1.36 | 0.356 | 1.000 | 1.42 | QNA | Download | 40,43,46,49,82,83 |
| 4 | 0.08 | 1p710 | 0.923 | 1.05 | 0.356 | 1.000 | 1.40 | III | Download | 1,2,3,6,9,10,13,14,16,24,27,28,29,31,32,33,34,36,37,40,41,42,43,44,47,50,52,74,75,76,77,79,81,85,88,89,90 |
| 5 | 0.07 | 1p51D | 0.849 | 1.69 | 0.356 | 1.000 | 1.45 | QNA | Download | 40,43,45,46,49,82,83 |
| 6 | 0.07 | 1b8z0 | 0.671 | 1.21 | 0.373 | 0.744 | 1.49 | III | Download | 1,2,3,6,10,13,24,27,28,29,31,33,34,35,36,40,41,42,43,44,47,52,77,79,81,88,89 |
| 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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