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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 | 1jppA | 0.310 | 6.20 | 0.066 | 0.411 | 0.25 | III | complex1.pdb.gz | 481,485,519 |
| 2 | 0.01 | 3p5rB | 0.317 | 7.52 | 0.054 | 0.464 | 0.20 | FGG | complex2.pdb.gz | 497,500,501,504,562 |
| 3 | 0.01 | 1jpwC | 0.308 | 6.19 | 0.051 | 0.409 | 0.18 | III | complex3.pdb.gz | 497,501,566,568,569 |
| 4 | 0.01 | 2gl7A | 0.317 | 6.09 | 0.046 | 0.416 | 0.21 | III | complex4.pdb.gz | 480,483,486,490,498 |
| 5 | 0.01 | 1t08A | 0.311 | 6.30 | 0.059 | 0.416 | 0.25 | III | complex5.pdb.gz | 501,502,505,574,607,613,614 |
| 6 | 0.01 | 1jppB | 0.298 | 6.14 | 0.050 | 0.394 | 0.20 | III | complex6.pdb.gz | 494,497,501,531,535,538,539 |
| 7 | 0.01 | 3p5rA | 0.302 | 7.90 | 0.044 | 0.453 | 0.18 | FGG | complex7.pdb.gz | 486,498,501,502,505 |
| 8 | 0.01 | 2ot8A | 0.344 | 6.99 | 0.046 | 0.472 | 0.25 | III | complex8.pdb.gz | 494,497,498,501,532 |
| 9 | 0.01 | 1i7x0 | 0.311 | 6.13 | 0.064 | 0.411 | 0.39 | III | complex9.pdb.gz | 492,498,523,526,529 |
| 10 | 0.01 | 1h39B | 0.305 | 6.47 | 0.036 | 0.406 | 0.10 | R03 | complex10.pdb.gz | 501,529,531,532 |
| 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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