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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 | 0.03 | 1sqfA | 0.765 | 2.24 | 0.165 | 0.917 | 0.35 | SAM | Download | 85,86,87,88,114 |
| 2 | 0.02 | 3a04A | 0.578 | 3.83 | 0.102 | 0.894 | 0.37 | SF4 | Download | 52,54,55,84,85,88 |
| 3 | 0.01 | 3a040 | 0.578 | 3.83 | 0.102 | 0.894 | 0.21 | III | Download | 21,22,54,55,56,79,80,82,83,86 |
| 4 | 0.01 | 2zueA | 0.567 | 4.02 | 0.082 | 0.917 | 0.11 | ANP | Download | 69,87,88 |
| 5 | 0.01 | 1jikA | 0.564 | 3.72 | 0.035 | 0.864 | 0.19 | 545 | Download | 22,58,83,87,90 |
| 6 | 0.01 | 1gaxA | 0.577 | 3.86 | 0.065 | 0.901 | 0.13 | VAA | Download | 83,84,88 |
| 7 | 0.01 | 3ts1A | 0.573 | 3.83 | 0.069 | 0.879 | 0.11 | TYA | Download | 85,89,92,102,106 |
| 8 | 0.01 | 1x8xA | 0.573 | 3.82 | 0.060 | 0.879 | 0.16 | TYR | Download | 88,91,100,106 |
| 9 | 0.01 | 2yxn0 | 0.573 | 3.82 | 0.060 | 0.879 | 0.25 | III | Download | 47,48,50,51,52,56,58,59,85,88,91 |
| 10 | 0.01 | 1vbnB | 0.571 | 3.76 | 0.060 | 0.871 | 0.14 | YSA | Download | 84,88,91 |
| 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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