{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["28(2)"],"submitter":["Usmani J"],"pubmed_abstract":["Sepsis is a serious health concern globally, which necessitates understanding the root cause of infection for the prevention of proliferation inside the host's body. Phytochemicals present in plants exhibit antibacterial and anti-proliferative properties stipulated for sepsis treatment. The aim of the study was to determine the potential role of <i>Carica papaya</i> leaf extract for sepsis treatment in silico and in vitro. We selected two phytochemical compounds, carpaine and quercetin, and docked them with bacterial proteins, heat shock protein (PDB ID: 4PO2), surfactant protein D (PDB ID: 1PW9), and lactobacillus bacterial protein (PDB ID: 4MKS) against imipenem and cyclophosphamide. Quercetin showed the strongest interaction with 1PW9 and 4MKS proteins. The leaves were extracted using e"],"journal":["Molecules (Basel, Switzerland)"],"pagination":["574"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC9862608"],"repository":["biostudies-literature"],"pubmed_title":["Molecular Docking of Bacterial Protein Modulators and Pharmacotherapeutics of <i>Carica papaya</i> Leaves as a Promising Therapy for Sepsis: Synchronising In Silico and In Vitro Studies."],"pmcid":["PMC9862608"],"pubmed_authors":["Kausar H","Ahmad R","Akbar S","Hassan MJ","Ansari MN","Rashid S","Mir SR","Usmani J","Sartaj A","Sharma M"],"additional_accession":[]},"is_claimable":false,"name":"Molecular Docking of Bacterial Protein Modulators and Pharmacotherapeutics of <i>Carica papaya</i> Leaves as a Promising Therapy for Sepsis: Synchronising In Silico and In Vitro Studies.","description":"Sepsis is a serious health concern globally, which necessitates understanding the root cause of infection for the prevention of proliferation inside the host's body. Phytochemicals present in plants exhibit antibacterial and anti-proliferative properties stipulated for sepsis treatment. The aim of the study was to determine the potential role of <i>Carica papaya</i> leaf extract for sepsis treatment in silico and in vitro. We selected two phytochemical compounds, carpaine and quercetin, and docked them with bacterial proteins, heat shock protein (PDB ID: 4PO2), surfactant protein D (PDB ID: 1PW9), and lactobacillus bacterial protein (PDB ID: 4MKS) against imipenem and cyclophosphamide. Quercetin showed the strongest interaction with 1PW9 and 4MKS proteins. The leaves were extracted using e","dates":{"release":"2023-01-01T00:00:00Z","publication":"2023 Jan","modification":"2025-04-04T14:30:37.81Z","creation":"2024-12-03T16:00:10.643Z"},"accession":"S-EPMC9862608","cross_references":{"pubmed":["36677632"],"doi":["10.3390/molecules28020574"]}}