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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 | 2hgu1 | 0.173 | 4.86 | 0.047 | 0.258 | 0.44 | III | complex1.pdb.gz | 146,147,150,151,154 |
| 2 | 0.01 | 1l0l7 | 0.156 | 3.72 | 0.073 | 0.198 | 0.56 | III | complex2.pdb.gz | 149,150,151,152,153,154,170,171,174,175,176,183 |
| 3 | 0.01 | 1vs80 | 0.126 | 3.88 | 0.051 | 0.169 | 0.41 | III | complex3.pdb.gz | 92,93,121,191,216 |
| 4 | 0.01 | 1vs82 | 0.184 | 4.68 | 0.113 | 0.278 | 0.56 | III | complex4.pdb.gz | 189,193,196,197,204 |
| 5 | 0.01 | 2hgu3 | 0.189 | 5.60 | 0.050 | 0.310 | 0.70 | III | complex5.pdb.gz | 143,144,145,151,156 |
| 6 | 0.01 | 1za18 | 0.197 | 5.23 | 0.046 | 0.306 | 0.54 | III | complex6.pdb.gz | 179,180,181,182,204,207 |
| | 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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