Atoms to Phenotypes: Molecular Design Principles of Cellular Energy Metabolism

Abhishek Singharoy; Christopher Maffeo; Karelia H. Delgado-Magnero; David J.K. Swainsbury; Melih Sener; Ulrich Kleinekathöfer; John W. Vant; Jonathan Nguyen; Andrew Hitchcock; Barry Isralewitz; Ivan Teo; Danielle E. Chandler; John E. Stone; James C. Phillips; Taras V. Pogorelov; M. Ilaria Mallus; Christophe Chipot; Zaida Luthey-Schulten; D. Peter Tieleman; C. Neil Hunter; Emad Tajkhorshid; Aleksei Aksimentiev; Klaus Schulten

doi:10.1016/j.cell.2019.10.021

Atoms to Phenotypes: Molecular Design Principles of Cellular Energy Metabolism

Abhishek Singharoy, Christopher Maffeo, Karelia H. Delgado-Magnero, David J.K. Swainsbury, Melih Sener, Ulrich Kleinekathöfer, John W. Vant, Jonathan Nguyen, Andrew Hitchcock, Barry Isralewitz, Ivan Teo, Danielle E. Chandler, John E. Stone, James C. Phillips, Taras V. Pogorelov, M. Ilaria Mallus, Christophe Chipot, Zaida Luthey-Schulten, D. Peter Tieleman, C. Neil HunterEmad Tajkhorshid, Aleksei Aksimentiev, Klaus Schulten

Molecular Sciences, School of (SMS)

Research output: Contribution to journal › Article › peer-review

105 Scopus citations

Abstract

A full atomic resolution model of an entire organelle, the photosynthetic chromatophore vesicle of a purple bacterium, is constructed and reveals how the photosynthetic apparatus is optimized for ATP production in low-light habitats.

Original language	English (US)
Pages (from-to)	1098-1111.e23
Journal	Cell
Volume	179
Issue number	5
DOIs	https://doi.org/10.1016/j.cell.2019.10.021
State	Published - Nov 14 2019

Keywords

MD
bioenergetics
biological membranes
charge transport
chromatophore
integrative model
mitochondria
molecular dynamics simulation
optical spectroscopy
photosynthesis

ASJC Scopus subject areas

General Biochemistry, Genetics and Molecular Biology

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10.1016/j.cell.2019.10.021

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Singharoy, A., Maffeo, C., Delgado-Magnero, K. H., Swainsbury, D. J. K., Sener, M., Kleinekathöfer, U., Vant, J. W., Nguyen, J., Hitchcock, A., Isralewitz, B., Teo, I., Chandler, D. E., Stone, J. E., Phillips, J. C., Pogorelov, T. V., Mallus, M. I., Chipot, C., Luthey-Schulten, Z., Tieleman, D. P., ... Schulten, K. (2019). Atoms to Phenotypes: Molecular Design Principles of Cellular Energy Metabolism. Cell, 179(5), 1098-1111.e23. https://doi.org/10.1016/j.cell.2019.10.021

Singharoy, A, Maffeo, C, Delgado-Magnero, KH, Swainsbury, DJK, Sener, M, Kleinekathöfer, U, Vant, JW, Nguyen, J, Hitchcock, A, Isralewitz, B, Teo, I, Chandler, DE, Stone, JE, Phillips, JC, Pogorelov, TV, Mallus, MI, Chipot, C, Luthey-Schulten, Z, Tieleman, DP, Hunter, CN, Tajkhorshid, E, Aksimentiev, A & Schulten, K 2019, 'Atoms to Phenotypes: Molecular Design Principles of Cellular Energy Metabolism', Cell, vol. 179, no. 5, pp. 1098-1111.e23. https://doi.org/10.1016/j.cell.2019.10.021

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title = "Atoms to Phenotypes: Molecular Design Principles of Cellular Energy Metabolism",

abstract = "A full atomic resolution model of an entire organelle, the photosynthetic chromatophore vesicle of a purple bacterium, is constructed and reveals how the photosynthetic apparatus is optimized for ATP production in low-light habitats.",

keywords = "MD, bioenergetics, biological membranes, charge transport, chromatophore, integrative model, mitochondria, molecular dynamics simulation, optical spectroscopy, photosynthesis",

author = "Abhishek Singharoy and Christopher Maffeo and Delgado-Magnero, {Karelia H.} and Swainsbury, {David J.K.} and Melih Sener and Ulrich Kleinekath{\"o}fer and Vant, {John W.} and Jonathan Nguyen and Andrew Hitchcock and Barry Isralewitz and Ivan Teo and Chandler, {Danielle E.} and Stone, {John E.} and Phillips, {James C.} and Pogorelov, {Taras V.} and Mallus, {M. Ilaria} and Christophe Chipot and Zaida Luthey-Schulten and Tieleman, {D. Peter} and Hunter, {C. Neil} and Emad Tajkhorshid and Aleksei Aksimentiev and Klaus Schulten",

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month = nov,

day = "14",

doi = "10.1016/j.cell.2019.10.021",

language = "English (US)",

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AU - Singharoy, Abhishek

AU - Maffeo, Christopher

AU - Delgado-Magnero, Karelia H.

AU - Swainsbury, David J.K.

AU - Sener, Melih

AU - Kleinekathöfer, Ulrich

AU - Vant, John W.

AU - Nguyen, Jonathan

AU - Hitchcock, Andrew

AU - Isralewitz, Barry

AU - Teo, Ivan

AU - Chandler, Danielle E.

AU - Stone, John E.

AU - Phillips, James C.

AU - Pogorelov, Taras V.

AU - Mallus, M. Ilaria

AU - Chipot, Christophe

AU - Luthey-Schulten, Zaida

AU - Tieleman, D. Peter

AU - Hunter, C. Neil

AU - Tajkhorshid, Emad

AU - Aksimentiev, Aleksei

AU - Schulten, Klaus

PY - 2019/11/14

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KW - bioenergetics

KW - biological membranes

KW - charge transport

KW - chromatophore

KW - integrative model

KW - mitochondria

KW - molecular dynamics simulation

KW - optical spectroscopy

KW - photosynthesis

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SP - 1098-1111.e23

JO - Cell

JF - Cell

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Atoms to Phenotypes: Molecular Design Principles of Cellular Energy Metabolism

Abstract

Keywords

ASJC Scopus subject areas

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