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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 | 0.07 | 2zcsA | 0.536 | 4.38 | 0.033 | 0.850 | 0.17 | B70 | complex1.pdb.gz | 23,42,43,46 |
| 2 | 0.01 | 3ddlA | 0.550 | 4.11 | 0.085 | 0.872 | 0.20 | RET | complex2.pdb.gz | 42,106,107 |
| 3 | 0.01 | 1yyuA | 0.529 | 3.98 | 0.031 | 0.782 | 0.10 | RAZ | complex3.pdb.gz | 8,108,115 |
| 4 | 0.01 | 2v7iA | 0.493 | 4.47 | 0.068 | 0.820 | 0.18 | HEM | complex4.pdb.gz | 93,94,97,100,101,105,106 |
| 5 | 0.01 | 3ae0A | 0.535 | 4.35 | 0.041 | 0.850 | 0.15 | GGS | complex5.pdb.gz | 9,39,46 |
| 6 | 0.01 | 1yyq0 | 0.529 | 4.04 | 0.031 | 0.789 | 0.14 | III | complex6.pdb.gz | 27,36,37,39,40,43,44,47,50,54,92,93,99 |
| 7 | 0.01 | 3acyA | 0.540 | 4.41 | 0.025 | 0.857 | 0.24 | 702 | complex7.pdb.gz | 5,15,117 |
| 8 | 0.01 | 2zy1A | 0.540 | 4.47 | 0.025 | 0.865 | 0.22 | 830 | complex8.pdb.gz | 6,10,22,24,25,26,27 |
| 9 | 0.01 | 2zcqA | 0.537 | 4.30 | 0.025 | 0.850 | 0.15 | B65 | complex9.pdb.gz | 8,110,120 |
| 10 | 0.01 | 1kizB | 0.529 | 4.05 | 0.031 | 0.789 | 0.14 | POP | complex10.pdb.gz | 33,38,41 |
| 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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