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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 | 0.53 | 2vcpA | 0.711 | 3.25 | 0.270 | 0.808 | 1.01 | ATP | complex1.pdb.gz | 21,22,23,24,26,142,143,144,145,168,208,212,307,308,309,311,312 |
| 2 | 0.26 | 1lcuB | 0.715 | 3.26 | 0.267 | 0.811 | 1.00 | LAR | complex2.pdb.gz | 23,24,40,143,168,169,172,205,208 |
| 3 | 0.17 | 2a40A | 0.685 | 3.40 | 0.275 | 0.787 | 1.05 | III | complex3.pdb.gz | 30,31,32,33,34,129,132,153,154,366 |
| 4 | 0.11 | 2pbdA | 0.711 | 3.30 | 0.262 | 0.808 | 1.01 | III | complex4.pdb.gz | 31,32,33,34,36,129 |
| 5 | 0.10 | 1yxqA | 0.706 | 3.14 | 0.265 | 0.796 | 0.90 | SWI | complex5.pdb.gz | 31,32,33,129,130,131,155,371 |
| 6 | 0.09 | 3mn6A | 0.712 | 3.30 | 0.267 | 0.811 | 0.91 | III | complex6.pdb.gz | 31,32,33,363,371 |
| 7 | 0.05 | 1d4x0 | 0.718 | 3.23 | 0.263 | 0.813 | 1.11 | III | complex7.pdb.gz | 31,32,33,129,130,153,154,155 |
| 8 | 0.05 | 1ma91 | 0.702 | 3.21 | 0.269 | 0.796 | 0.99 | III | complex8.pdb.gz | 129,130,131,132,152,153,155,157,159,285,286,289,290,292,293,294,296,297,301,342 |
| 9 | 0.05 | 3m1fA | 0.712 | 3.22 | 0.262 | 0.808 | 0.96 | III | complex9.pdb.gz | 31,32,33,367,370,371 |
| 10 | 0.05 | 2a410 | 0.715 | 3.32 | 0.261 | 0.813 | 0.90 | III | complex10.pdb.gz | 24,31,32,33,34,35,36,38,79,129,132,153,154,155,205,206,208,209 |
| 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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