Quorumpeps Molecule
Quorumpeps®
Download optimized .hin file.
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The geometry optimization was obtained by the molecular mechanics force field method, using the Polak–Ribière conjugate gradient algorithm with a rootmean-square (RMS) gradient of 0.1 kcal/ (Å×mol) as stop criterion using the Hyperchem Professional 8.0 software (Hypercube, Gainesville, FL, USA). The structure can be rotated by dragging the structure; zooming is possible by scrolling on it.
QNSPNIFGQWM, lacton linkage between S3 and M11
| Quorumpeps moleculeID | 97 |
| SMILES | O=C(N)CCC(N)C(=O)NC(C(=O)NC1C(=O)N5C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)OC1)CCSC)Cc3c2ccccc2nc3)CCC(=O)N)Cc4ccccc4)C(C)CC)CC(=O)N)CCC5)CC(=O)N |
| Molecular formula | C59H82N16O16S |
Chemical information
| Quorumpeps moleculeID | 97 |
| Sequence | QNSPNIFGQWM, lacton linkage between S3 and M11 |
| Trivial names | GBAP, Gelatinase Biosynthesis-Activating Pheromone |
| SMILES | O=C(N)CCC(N)C(=O)NC(C(=O)NC1C(=O)N5C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)OC1)CCSC)Cc3c2ccccc2nc3)CCC(=O)N)Cc4ccccc4)C(C)CC)CC(=O)N)CCC5)CC(=O)N |
| Molecular formula | C59H82N16O16S |
| Molecular weight | 1303.63 |
| LogP | -7.75 |
| Isoelectric point (pl) | 9.41 |
Species origin
Functionality
Links
Literature
