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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 | 0.057 | 5.50 | 0.046 | 0.071 | 0.25 | III | complex1.pdb.gz | 129,130,147 |
| 2 | 0.01 | 3cqzA | 0.176 | 8.35 | 0.021 | 0.268 | 0.14 | III | complex2.pdb.gz | 144,145,146,196,197,199 |
| 3 | 0.01 | 1mmdA | 0.193 | 8.62 | 0.037 | 0.300 | 0.17 | UUU | complex3.pdb.gz | 134,136,137,138,139,143,166 |
| 4 | 0.01 | 1d0xA | 0.190 | 8.73 | 0.033 | 0.297 | 0.16 | MNQ | complex4.pdb.gz | 172,173,174,175 |
| 5 | 0.01 | 2jhrA | 0.186 | 9.04 | 0.024 | 0.301 | 0.11 | AD9 | complex5.pdb.gz | 141,142,143,144 |
| 6 | 0.01 | 1d0zA | 0.189 | 8.49 | 0.031 | 0.289 | 0.18 | PNQ | complex6.pdb.gz | 134,145,146,171,172,173,174 |
| 7 | 0.01 | 2fmm7 | 0.066 | 4.60 | 0.050 | 0.076 | 0.12 | III | complex7.pdb.gz | 186,189,191 |
| 8 | 0.01 | 1twc1 | 0.066 | 3.82 | 0.053 | 0.074 | 0.10 | III | complex8.pdb.gz | 199,200,201 |
| 9 | 0.01 | 1l0l7 | 0.058 | 3.61 | 0.026 | 0.065 | 0.26 | III | complex9.pdb.gz | 127,128,181 |
| 10 | 0.01 | 1l0l9 | 0.039 | 3.73 | 0.107 | 0.044 | 0.32 | III | complex10.pdb.gz | 130,147,148,155,228 |
| 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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