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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 | 1i7x3 | 0.313 | 6.34 | 0.066 | 0.426 | 0.13 | III | complex1.pdb.gz | 484,485,520,521,557,584 |
| 2 | 0.01 | 2gl7A | 0.312 | 6.57 | 0.063 | 0.434 | 0.31 | III | complex2.pdb.gz | 380,387,391,414,415,422,427,430 |
| 3 | 0.01 | 1i7x0 | 0.313 | 6.34 | 0.066 | 0.426 | 0.23 | III | complex3.pdb.gz | 422,423,426,427,429 |
| 4 | 0.01 | 2xpiA | 0.362 | 4.63 | 0.097 | 0.424 | 0.37 | III | complex4.pdb.gz | 520,521,527,549,551,555,558,561,585,589,592,595,596,619 |
| 5 | 0.01 | 1jpwA | 0.287 | 6.80 | 0.065 | 0.409 | 0.13 | III | complex5.pdb.gz | 423,427,430 |
| 6 | 0.01 | 1t08A | 0.309 | 6.31 | 0.068 | 0.421 | 0.12 | III | complex6.pdb.gz | 554,555,585 |
| | 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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