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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 | 1zw2A | 0.242 | 4.50 | 0.047 | 0.320 | 0.54 | III | complex1.pdb.gz | 144,151,184,188,191,195,198,202 |
| 2 | 0.01 | 2gdcA | 0.241 | 5.69 | 0.023 | 0.360 | 0.50 | III | complex2.pdb.gz | 144,177,184,188,191,192,195 |
| 3 | 0.01 | 3cq8A | 0.364 | 5.99 | 0.054 | 0.567 | 0.67 | NA | complex3.pdb.gz | 264,265,268,272 |
| 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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