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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 | 0.05 | 2nxn1 | 0.688 | 2.41 | 0.219 | 0.818 | 1.12 | III | complex1.pdb.gz | 14,15,16,18,21,26,27,29,30,31,40,44,45,47,48,49,51,52,76,78,82,138,139 |
| 2 | 0.04 | 2zjpF | 0.658 | 3.00 | 0.184 | 0.830 | 0.83 | III | complex2.pdb.gz | 26,27,30,31 |
| 3 | 0.03 | 3cf5F | 0.663 | 2.78 | 0.171 | 0.824 | 0.66 | III | complex3.pdb.gz | 30,36,37 |
| 4 | 0.01 | 1n38A | 0.448 | 5.25 | 0.050 | 0.782 | 0.61 | CH1 | complex4.pdb.gz | 29,30,34,35,36,37 |
| 5 | 0.01 | 3m6gA | 0.429 | 5.59 | 0.047 | 0.764 | 0.63 | LO3 | complex5.pdb.gz | 131,134,135,138,139 |
| 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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