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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 | 0.07 | 1nf4H | 0.673 | 2.41 | 0.069 | 0.843 | 0.53 | FEC | Download | 19,34,64 |
| 2 | 0.06 | 1nf6J | 0.672 | 2.40 | 0.069 | 0.843 | 0.51 | FEC | Download | 15,22,26,30,67,74,78 |
| 3 | 0.02 | 1cxz1 | 0.678 | 2.52 | 0.066 | 0.855 | 0.95 | III | Download | 23,29,30,33,34,36,37,40,41,43,44,57,58,61,64,65,68 |
| 4 | 0.01 | 3foeA | 0.450 | 3.40 | 0.037 | 0.687 | 0.57 | QNA | Download | 26,67,69,72 |
| 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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