title: Comparative Molecular Docking Studies with ABCC1 and Aquaporin 9 in the Arsenite Complex Efflux.
abstract: Arsenic is the most toxic metalloid present in the natural environment in both organic and inorganic arsenic forms. Inorganic arsenic is often more hazardous than the organic form. Arsenite and arsenate compounds are the major inorganic forms which are toxic causing severe human health dysfunction including cancer. Excretion of arsenic from the system is found elusive. Therefore, it is of interest to screen channel proteins with the arsenic complex in the different combination of arsenic, GSH (glutathione) and arsenic, selenium using docking methods. The mode of arsenic removal. The complex structure revealed the mode of arsenic binding efficiency with the receptor aquaporine 9 and ABCC1 channel protein. This provides insights to understand the mechanism of arsenic efflux. These inferences find application in the design, identification and development of novel nutracetucal or any other formulation useful in the balance of arsenic efflux.
authors.affiliation: Environmental Carcinogenesis Division, CSIR-Indian Institute of Toxicology Research, Mahatma Gandhi Marg, P Box 80, Lucknow-226001 ; Environmental Carcinogenesis & Toxicoinformatics Laboratory, Departments of Biosciences, Integral University, Lucknow-226026.
authors.forename: Shiv
authors.initials: S
authors.lastname: Poojan
authors.affiliation: Environmental Carcinogenesis & Toxicoinformatics Laboratory, Departments of Biosciences, Integral University, Lucknow-226026.
authors.forename: Anupam
authors.initials: A
authors.lastname: Dhasmana
authors.affiliation: Environmental Carcinogenesis & Toxicoinformatics Laboratory, Departments of Biosciences, Integral University, Lucknow-226026.
authors.forename: Qazi Mohammad Sajid
authors.initials: QM
authors.lastname: Jamal
authors.affiliation: Environmental Carcinogenesis & Toxicoinformatics Laboratory, Departments of Biosciences, Integral University, Lucknow-226026.
authors.forename: Mohd
authors.initials: M
authors.lastname: Haneef
authors.affiliation: Environmental Carcinogenesis & Toxicoinformatics Laboratory, Departments of Biosciences, Integral University, Lucknow-226026.
authors.forename: Mohtashim
authors.initials: M
authors.lastname: Lohani
keywords: Arsenic toxicity; Molecular Docking; Transport Channels