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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 | 0.07 | 1un9A | 0.320 | 1.80 | 0.137 | 0.331 | 1.33 | ANP | Download | 35,37,38,41,79,80,83,120,122,128,129,181,183 |
| 2 | 0.03 | 2btdA | 0.342 | 2.14 | 0.147 | 0.360 | 1.10 | MG | Download | 35,37,78 |
| 3 | 0.02 | 1un8A | 0.324 | 1.87 | 0.134 | 0.336 | 0.99 | MYY | Download | 10,14,18,45,61,65,68,76,84,88,106,110,194 |
| 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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