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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 | 0.04 | 3b2pA | 0.419 | 7.47 | 0.034 | 0.707 | 0.12 | ARG | complex1.pdb.gz | 395,396,399 |
| 2 | 0.01 | 3mdjC | 0.391 | 7.46 | 0.045 | 0.654 | 0.18 | BES | complex2.pdb.gz | 370,373,374 |
| 3 | 0.01 | 3q7jA | 0.402 | 7.46 | 0.042 | 0.673 | 0.10 | FBO | complex3.pdb.gz | 367,368,369,376,389,390,403 |
| 4 | 0.01 | 3mdjA | 0.378 | 7.27 | 0.026 | 0.621 | 0.38 | UUU | complex4.pdb.gz | 355,357,360 |
| 5 | 0.01 | 1w1i0 | 0.395 | 7.63 | 0.025 | 0.673 | 0.11 | III | complex5.pdb.gz | 337,387,388,391,392,394,395,398,399,405,406 |
| 6 | 0.01 | 2qt9A | 0.401 | 7.37 | 0.034 | 0.669 | 0.17 | UUU | complex6.pdb.gz | 357,361,362,363 |
| 7 | 0.01 | 2rguB | 0.402 | 7.33 | 0.034 | 0.665 | 0.11 | 356 | complex7.pdb.gz | 359,360,361,401 |
| 8 | 0.01 | 2zxgA | 0.418 | 7.48 | 0.034 | 0.704 | 0.13 | S23 | complex8.pdb.gz | 371,374,375 |
| 9 | 0.01 | 2bgn0 | 0.395 | 7.50 | 0.031 | 0.669 | 0.19 | III | complex9.pdb.gz | 339,401,407 |
| 10 | 0.01 | 2oncB | 0.402 | 7.40 | 0.034 | 0.669 | 0.15 | SY1 | complex10.pdb.gz | 333,334,401 |
| 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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