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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 | 0.90 | 2b7bA | 0.717 | 4.41 | 0.667 | 0.896 | 1.69 | GDP | complex1.pdb.gz | 15,16,17,18,19,20,21,22,153,154,156,194,195,196 |
| 2 | 0.10 | 1f600 | 0.723 | 4.50 | 0.671 | 0.905 | 0.84 | III | complex2.pdb.gz | 252,253,254,256,259,262,291,293,295,296,309,311,322,430 |
| 3 | 0.04 | 2d740 | 0.651 | 3.18 | 0.247 | 0.736 | 0.90 | III | complex3.pdb.gz | 23,26,34,152,155,156,158,163,166,167,171,187,189,192,195,197,198,199,200,201,230,234,235 |
| 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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