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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 | 0.84 | 1i5eA | 0.927 | 1.81 | 0.551 | 1.000 | 1.64 | U5P | Download | 129,131,133,134,135,136,137,190,191,192,197,198,199 |
| 2 | 0.71 | 3g6wD | 0.912 | 1.71 | 0.333 | 0.986 | 1.49 | PRP | Download | 76,77,78,101,102,129,132,133,134,135,136,137 |
| 3 | 0.71 | 1jlsB | 0.885 | 2.29 | 0.338 | 1.000 | 1.53 | URA | Download | 131,190,191,192,197,198,199 |
| 4 | 0.54 | 1bd3C | 0.884 | 2.28 | 0.338 | 1.000 | 1.48 | PO4 | Download | 102,133,134,135,136,137 |
| 5 | 0.18 | 1qk5B | 0.586 | 3.59 | 0.150 | 0.758 | 0.82 | UUU | Download | 77,78,99,101,130,131,133,134,135,137,161,200,201 |
| 6 | 0.17 | 1qk5A | 0.582 | 3.64 | 0.151 | 0.754 | 1.00 | POP | Download | 77,78,99,101,201,205 |
| 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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