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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 | 0.08 | 1oaxH | 0.510 | 2.11 | 0.198 | 0.564 | 0.63 | ANQ | complex1.pdb.gz | 64,66,72,116,131 |
| 2 | 0.07 | 1ct8B | 0.598 | 3.80 | 0.158 | 0.766 | 0.62 | TAA | complex2.pdb.gz | 65,67,72,115,117,135 |
| 3 | 0.05 | 1uz8B | 0.582 | 4.19 | 0.140 | 0.782 | 0.64 | UUU | complex3.pdb.gz | 66,115,134 |
| 4 | 0.03 | 1oaz3 | 0.510 | 2.07 | 0.198 | 0.564 | 0.62 | III | complex4.pdb.gz | 54,55,56,60,119,121,122,123,124 |
| 5 | 0.03 | 2g5bB | 0.598 | 3.88 | 0.149 | 0.772 | 0.71 | UUU | complex5.pdb.gz | 59,119,121,123,124,126,128 |
| 6 | 0.03 | 3hnsH | 0.587 | 4.03 | 0.158 | 0.766 | 0.64 | UUU | complex6.pdb.gz | 62,64,75,120,122,123 |
| 7 | 0.03 | 1pz5B | 0.586 | 4.09 | 0.158 | 0.772 | 0.63 | III | complex7.pdb.gz | 58,59,60,81,122,123 |
| 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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