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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 | 2z5oA | 0.335 | 7.09 | 0.074 | 0.442 | 0.17 | III | complex1.pdb.gz | 12,55,63 |
| 2 | 0.01 | 2ot8A | 0.320 | 6.49 | 0.043 | 0.407 | 0.19 | III | complex2.pdb.gz | 100,145,149,213 |
| 3 | 0.01 | 1w9c0 | 0.246 | 3.03 | 0.097 | 0.264 | 0.16 | III | complex3.pdb.gz | 10,13,14,17 |
| 4 | 0.01 | 2bptA | 0.351 | 7.49 | 0.048 | 0.473 | 0.22 | III | complex4.pdb.gz | 10,12,13,14,16,17,18,54,56 |
| 5 | 0.01 | 1xmsA | 0.093 | 5.51 | 0.024 | 0.113 | 0.13 | ANP | complex5.pdb.gz | 12,13,14,15,16,17 |
| 6 | 0.01 | 2l1lB | 0.102 | 3.60 | 0.106 | 0.112 | 0.28 | III | complex6.pdb.gz | 8,12,16,20,49,54,55,57 |
| 7 | 0.01 | 2z5kA | 0.321 | 6.69 | 0.049 | 0.414 | 0.10 | III | complex7.pdb.gz | 54,100,107,150 |
| 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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