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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 | 2j6e2 | 0.190 | 6.12 | 0.040 | 0.310 | 0.51 | III | complex1.pdb.gz | 285,286,291,292 |
| 2 | 0.01 | 3i4mB | 0.366 | 6.77 | 0.050 | 0.658 | 0.47 | QNA | complex2.pdb.gz | 278,279,294,296 |
| 3 | 0.01 | 1hnz6 | 0.169 | 4.96 | 0.033 | 0.243 | 0.45 | III | complex3.pdb.gz | 250,251,255 |
| 4 | 0.01 | 1hnz8 | 0.094 | 4.08 | 0.057 | 0.121 | 0.43 | III | complex4.pdb.gz | 255,259,260,279,291,295,296 |
| 5 | 0.01 | 1zyrM | 0.415 | 6.23 | 0.069 | 0.677 | 0.59 | STD | complex5.pdb.gz | 288,290,291,303 |
| 6 | 0.01 | 3po3B | 0.354 | 6.88 | 0.054 | 0.639 | 0.41 | UUU | complex6.pdb.gz | 278,279,297 |
| 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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