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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 | 3owaB | 0.359 | 6.49 | 0.050 | 0.534 | 0.45 | FAD | Download | 80,111,114,196 |
| 2 | 0.01 | 2zo5A | 0.313 | 7.18 | 0.036 | 0.510 | 0.45 | HEC | Download | 82,86,107,110,111,117,154 |
| 3 | 0.01 | 1fs7A | 0.372 | 6.29 | 0.043 | 0.542 | 0.40 | HEM | Download | 81,107,110,114,156 |
| 4 | 0.01 | 2z1qA | 0.386 | 6.40 | 0.070 | 0.580 | 0.52 | FAD | Download | 81,195,196 |
| 5 | 0.01 | 3owaC | 0.407 | 6.24 | 0.054 | 0.601 | 0.41 | FAD | Download | 81,108,156 |
| 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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