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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 | 1gmcG | 0.269 | 4.60 | 0.051 | 0.642 | 0.53 | III | complex1.pdb.gz | 7,24,25,26,27 |
| 2 | 0.01 | 1gg6B | 0.265 | 5.04 | 0.036 | 0.672 | 0.54 | APL | complex2.pdb.gz | 6,23,54,55,61,63 |
| 3 | 0.01 | 1elvA | 0.439 | 4.20 | 0.063 | 0.895 | 0.66 | UUU | complex3.pdb.gz | 4,6,8,10,19 |
| 4 | 0.01 | 1afqC | 0.273 | 4.45 | 0.052 | 0.627 | 0.55 | 0FG | complex4.pdb.gz | 38,41,42,43,44,47 |
| 5 | 0.01 | 2p8oC | 0.266 | 4.43 | 0.019 | 0.642 | 0.56 | BVA | complex5.pdb.gz | 8,9,10,24,25,26,57 |
| 6 | 0.01 | 1ynj8 | 0.322 | 4.66 | 0.049 | 0.746 | 0.56 | III | complex6.pdb.gz | 9,19,23,24,41,42,52 |
| 7 | 0.01 | 2bsq4 | 0.194 | 3.77 | 0.000 | 0.403 | 0.58 | III | complex7.pdb.gz | 7,8,28,31,32,33,34,35 |
| 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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