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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 | 2c88A | 0.383 | 5.87 | 0.033 | 0.556 | 0.19 | ACP | complex1.pdb.gz | 96,159,160 |
| 2 | 0.01 | 2agvB | 0.384 | 5.82 | 0.069 | 0.556 | 0.16 | BHQ | complex2.pdb.gz | 113,114,117 |
| 3 | 0.01 | 3fgoA | 0.385 | 5.94 | 0.041 | 0.564 | 0.26 | CZA | complex3.pdb.gz | 132,138,139,142,148 |
| 4 | 0.01 | 3fpsA | 0.388 | 5.95 | 0.032 | 0.564 | 0.32 | CZA | complex4.pdb.gz | 200,203,204 |
| 5 | 0.01 | 2o9jA | 0.365 | 6.08 | 0.061 | 0.564 | 0.23 | CZA | complex5.pdb.gz | 184,185,195,196 |
| 6 | 0.01 | 3ar3A | 0.385 | 6.19 | 0.029 | 0.579 | 0.38 | PTY | complex6.pdb.gz | 173,177,198 |
| 7 | 0.01 | 3b8eA | 0.405 | 5.58 | 0.067 | 0.569 | 0.11 | III | complex7.pdb.gz | 88,91,102,110,113 |
| 8 | 0.01 | 3b9rB | 0.394 | 5.85 | 0.029 | 0.571 | 0.11 | ACP | complex8.pdb.gz | 168,172,173,174 |
| 9 | 0.01 | 3b9rA | 0.394 | 6.11 | 0.051 | 0.584 | 0.11 | ACP | complex9.pdb.gz | 174,175,176 |
| 10 | 0.01 | 2dqsA | 0.381 | 5.90 | 0.035 | 0.553 | 0.17 | ACP | complex10.pdb.gz | 159,172,176 |
| 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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