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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 | 3cmvF | 0.195 | 9.48 | 0.040 | 0.303 | 0.16 | ANP | complex1.pdb.gz | 45,89,92 |
| 2 | 0.01 | 3cmvG | 0.198 | 9.70 | 0.032 | 0.313 | 0.13 | ANP | complex2.pdb.gz | 30,31,63,69 |
| 3 | 0.01 | 3cmvD | 0.185 | 9.23 | 0.048 | 0.282 | 0.17 | ANP | complex3.pdb.gz | 42,45,71,88 |
| 4 | 0.01 | 3tw6C | 0.256 | 8.62 | 0.037 | 0.371 | 0.24 | PAE | complex4.pdb.gz | 89,90,91 |
| 5 | 0.01 | 3cmvA | 0.210 | 9.51 | 0.043 | 0.328 | 0.24 | ANP | complex5.pdb.gz | 44,45,85,88 |
| 6 | 0.01 | 3cmvA | 0.210 | 9.51 | 0.043 | 0.328 | 0.14 | ANP | complex6.pdb.gz | 15,63,69 |
| 7 | 0.01 | 3tw6C | 0.256 | 8.62 | 0.037 | 0.371 | 0.20 | ADP | complex7.pdb.gz | 40,63,71 |
| 8 | 0.01 | 2qf7B | 0.230 | 9.19 | 0.027 | 0.350 | 0.15 | SAP | complex8.pdb.gz | 65,66,70 |
| 9 | 0.01 | 1c9iA | 0.111 | 7.52 | 0.052 | 0.151 | 0.21 | III | complex9.pdb.gz | 29,30,66,72 |
| 10 | 0.01 | 3cmvG | 0.198 | 9.70 | 0.032 | 0.313 | 0.21 | ANP | complex10.pdb.gz | 41,43,44 |
| 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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