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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 | 0.01 | 1fo4A | 0.459 | 6.14 | 0.048 | 0.808 | 0.53 | FES | complex1.pdb.gz | 36,38,39,46,49 |
| 2 | 0.01 | 1fiqA | 0.197 | 4.10 | 0.069 | 0.276 | 0.41 | FES | complex2.pdb.gz | 22,23,24,26,71 |
| 3 | 0.01 | 2ckjD | 0.355 | 6.55 | 0.060 | 0.660 | 0.56 | FES | complex3.pdb.gz | 56,57,58,59,62,63,64,65 |
| 4 | 0.01 | 1fiqA | 0.197 | 4.10 | 0.069 | 0.276 | 0.40 | FES | complex4.pdb.gz | 36,37,38,41,42,89,91 |
| 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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