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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 | 0.02 | 2xl2A | 0.401 | 2.34 | 0.144 | 0.424 | 0.68 | III | complex1.pdb.gz | 62,63,65,66,90,101,124 |
| 2 | 0.02 | 1xhmA | 0.399 | 2.19 | 0.132 | 0.420 | 0.44 | III | complex2.pdb.gz | 54,56,96,98,115,136,316 |
| 3 | 0.01 | 1omw3 | 0.399 | 2.19 | 0.132 | 0.420 | 0.54 | III | complex3.pdb.gz | 49,51,53,54,56,72,96,138,274 |
| 4 | 0.01 | 1utcB | 0.352 | 4.03 | 0.059 | 0.413 | 0.69 | III | complex4.pdb.gz | 56,71,73,96,137 |
| 5 | 0.01 | 2xzhA | 0.354 | 3.97 | 0.058 | 0.411 | 0.41 | VH2 | complex5.pdb.gz | 58,71,110,122 |
| 6 | 0.01 | 1utcA | 0.352 | 3.98 | 0.062 | 0.411 | 0.51 | III | complex6.pdb.gz | 57,71,97,138 |
| 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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