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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 | 3geeA | 0.570 | 3.96 | 0.078 | 0.927 | 0.29 | GDP | Download | 18,20,21,22,23 |
| 2 | 0.01 | 2z55B | 0.567 | 2.64 | 0.075 | 0.781 | 0.23 | 22B | Download | 20,21,24,73,76,77,80,84,88 |
| 3 | 0.01 | 2z55D | 0.565 | 2.65 | 0.075 | 0.781 | 0.24 | 22B | Download | 17,18,21,25,28,79,80,91 |
| 4 | 0.01 | 2ei4A | 0.561 | 2.69 | 0.075 | 0.781 | 0.21 | UUU | Download | 19,23,26,27 |
| 5 | 0.01 | 3abmP | 0.605 | 3.18 | 0.048 | 0.865 | 0.13 | UUU | Download | 22,92,93 |
| 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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