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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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| VCRTGRSRWRDVCRNFMRRYQSR | glutaric acid | coumarone derivative TB5, antitubercular drug |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00639 |
| Smiles | |
| Inchi Key | InChIKey=QOXRBGZNYFUVIZ-ARRYLFMISA-N |
| Molecular weight | 3519.71 |
| Molecular formula | C153H234N52O39S3 |
| Chemical name | Peptide information |
| Sequence (one letter) | VCRTGRSRWRDVCRNFMRRYQSR |
| Length | 23 |
| Peptide name | GranF2 granulysin |
| External ID | |
|---|---|
| CAS number | 1373532-18-3 |
| Other information | |
|---|---|
| Application | Antimicrobial therapy, anti-tuberculotic |
| Additional function | Targeting GranF2 and OT20, enhance cellular uptake, overcome drug resistance |
| Conjugate type | amide |
| Linker | N/A |
| Linker Type | glutaric acid |
| Small molecule | coumarone derivative TB5, antitubercular drug |
| Small molecule CAS | 899387-20-3 |
| Small molecule structure | |
| Structure method | 1H- and 13C-NMR |
| Calculated properties | |
|---|---|
| LogP | -16.23198 |
| Rotatable bonds | 114 |
| H bond donor | 51 |
| H bond acceptor | 64 |
| Polar surface area (PSA) | 1530.53000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Enhanced Cellular Uptake of a New, in Silico Identified Antitubercular Candidate by Peptide Conjugation | 2012 | Horvati, Kata; Bacsa, Bernadett; Szabo, Nora; David, Sandor; Mezo, Gabor; Grolmusz, Vince; Vertessy, Beata; Hudecz, Ferenc; Bosze, Szilvia | Bioconjugate Chemistry | ||
