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Detail Modes of Binding Assessed by Bulk and Single Molecular Level Fluorescence, MD Simulation, and Its Temperature Dependence: Coumarin 152 with Human Serum Albumin Revisited

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Selected Topics in Photonics

Part of the book series: IITK Directions ((IITKD,volume 2))

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Abstract

This study describes the effect of temperature on binding parameters as well as mode of binding between coumarin 152 (C152) and human serum albumin (HSA). Site marker competitive experiment, Förster resonance energy transfer (FRET), and molecular docking study show that C152 binds to the digitoxin binding site in domain III of HSA. The binding constant calculated at the single molecular level experiment matches well with the ensemble average measurement, which indicate that at even low dye concentration the binding reaction proceeds with equal probability. Further, FRET and molecular dynamic simulation confirm that the binding location of C152 is independent on temperature (278 K to 323 K). It has been revealed that the binding affinity of C152 to HSA was almost unaffected until 298 K; afterward, it decreases continuously on increasing temperature forming two distinct regions. Thermodynamic parameters for association indicate that strong electrostatic and hydrophobic interactions are operational at lower temperature region, whereas hydrogen bonding predominates at higher temperate region.

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Acknowledgements

RY thanks University Grants Commission, Government of India and BS thanks Council of Scientific and Industrial Research for providing fellowship. This work is financially supported by SERB, DST, Government of India.

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Authors and Affiliations

  1. Department of Chemistry, Indian Institute of Technology Kanpur, Kanpur, 208 016, UP, India

    Rajeev Yadav, Bhaswati Sengupta & Pratik Sen

  2. Department of Chemistry, Bowling Green State University, Bowling Green, OH, 43403-0001, USA

    Rajeev Yadav

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  1. Rajeev Yadav
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  2. Bhaswati Sengupta
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  3. Pratik Sen
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Correspondence to Pratik Sen .

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Editors and Affiliations

  1. Department of Physics, Indian Institute of Technology Kanpur, Kanpur, Uttar Pradesh, India

    Asima Pradhan

  2. Department of Electrical Engineering, Indian Institute of Technology Kanpur, Kanpur, Uttar Pradesh, India

    Pradeep Kumar Krishnamurthy

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Yadav, R., Sengupta, B., Sen, P. (2018). Detail Modes of Binding Assessed by Bulk and Single Molecular Level Fluorescence, MD Simulation, and Its Temperature Dependence: Coumarin 152 with Human Serum Albumin Revisited. In: Pradhan, A., Krishnamurthy, P. (eds) Selected Topics in Photonics. IITK Directions, vol 2. Springer, Singapore. https://doi.org/10.1007/978-981-10-5010-7_1

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  • DOI: https://doi.org/10.1007/978-981-10-5010-7_1

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