Identifying novel inhibitor of quorum sensing transcriptional regulator (SdiA) of Klebsiella pneumoniae through modelling, docking and molecular dynamics simulation

Mohammad Z. Ahmed; Ghazala Muteeb; Saif Khan; Ali S. Alqahtani; Pallavi Somvanshi; Mohammed S. Alqahtani; Keshav Lalit Ameta; Shafiul Haque

doi:10.1080/07391102.2020.1767209

journal article May 20, 2020

Identifying novel inhibitor of quorum sensing transcriptional regulator (SdiA) of Klebsiella pneumoniae through modelling, docking and molecular dynamics simulation

Mohammad Z. Ahmed Ghazala Muteeb

Saif Khan Ali S. Alqahtani

Pallavi Somvanshi

Mohammed S. Alqahtani

Keshav Lalit Ameta Shafiul Haque

Journal of Biomolecular Structure and Dynamics Vol. 39 No. 10 pp. 3594-3604 · Informa UK Limited

View at Publisher Save 10.1080/07391102.2020.1767209

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Details

Published: May 20, 2020
Vol/Issue: 39(10)
Pages: 3594-3604

Authors

M

Mohammad Z. Ahmed

Department of Pharmacognosy, College of Pharmacy, King Saud University, Riyadh, Saudi Arabia

G

Ghazala Muteeb

Department of Nursing, College of Applied Medical Sciences, King Faisal University, Saudi Arabia

S

Saif Khan

Department of Basic Medical and Dental Science, College of Dentistry, University of Ha’il, Ha’il, Saudi Arabia

A

Ali S. Alqahtani

Department of Pharmacognosy, College of Pharmacy, King Saud University, Riyadh, Saudi Arabia

P

Pallavi Somvanshi

Department of Biotechnology, TERI School of Advanced Studies, Plot No. 10, Institutional Area, Vasant Kunj, India

M

Mohammed S. Alqahtani

Departmental of Pharmaceutics, College of Pharmacy, King Saud University, Riyadh, Saudi Arabia

K

Keshav Lalit Ameta

Department of Chemistry, Mody University of Science and Technology, Lakshmangarh, Rajasthan, India

S

Shafiul Haque

Research and Scientific Studies Unit, College of Nursing & Allied Health Sciences, Jazan University, Jazan, Saudi Arabia

Funding

Deanship of Scientific Research at King Saud University

Cite This Article

Mohammad Z. Ahmed, Ghazala Muteeb, Saif Khan, et al. (2020). Identifying novel inhibitor of quorum sensing transcriptional regulator (SdiA) of Klebsiella pneumoniae through modelling, docking and molecular dynamics simulation. Journal of Biomolecular Structure and Dynamics, 39(10), 3594-3604. https://doi.org/10.1080/07391102.2020.1767209

Identifying novel inhibitor of quorum sensing transcriptional regulator (SdiA) of Klebsiella pneumoniae through modelling, docking and molecular dynamics simulation

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