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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 | 0.79 | 1y6qA | 0.969 | 0.77 | 0.324 | 0.986 | 1.54 | TDI | Download | 8,45,71,72,73,136,137,138,159,160,161,183,184,196 |
| 2 | 0.70 | 1z5nB | 0.966 | 0.83 | 0.319 | 0.986 | 1.36 | SR1 | Download | 7,8,11,45,71,137,160,161,180,196 |
| 3 | 0.64 | 1z34A | 0.777 | 2.75 | 0.171 | 0.909 | 1.28 | 2FD | Download | 45,71,72,73,134,137,158,159,160,161 |
| 4 | 0.25 | 3p0eA | 0.812 | 2.75 | 0.106 | 0.950 | 0.90 | PO4 | Download | 7,11,68,70,71 |
| 5 | 0.25 | 3kvrA | 0.817 | 2.74 | 0.105 | 0.954 | 0.87 | R2G | Download | 45,68,71,136,161 |
| 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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