Literature DB >> 29669180

Nanosecond Dynamics Regulate the MIF-Induced Activity of CD74.

Georgios Pantouris1, Junming Ho2,3, Dilip Shah4, Mansoor Ali Syed5, Lin Leng6, Vineet Bhandari4,5, Richard Bucala6,7, Victor S Batista2, J Patrick Loria2,8, Elias J Lolis1,7.   

Abstract

Macrophage migration inhibitory factor (MIF) activates CD74, which leads to severe disorders including inflammation, autoimmune diseases and cancer under pathological conditions. Molecular dynamics (MD) simulations up to one microsecond revealed dynamical correlation between a residue located at the opening of one end of the MIF solvent channel, previously thought to be a consequence of homotrimerization, and residues in a distal region responsible for CD74 activation. Experiments verified the allosteric regulatory site and identified a pathway to this site via the MIF β-strands. The reported findings provide fundamental insights on a dynamic mechanism that controls the MIF-induced activation of CD74.
© 2018 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Entities:  

Keywords:  MIF; allosteric sites; long-range communication; protein dynamics

Mesh：

Substances：

Year:  2018        PMID： 29669180      PMCID： PMC6282165          DOI： 10.1002/anie.201803191

Source DB:  PubMed          Journal:  Angew Chem Int Ed Engl        ISSN： 1433-7851            Impact factor:   15.336


  21 in total

1.  Allosteric inhibition of macrophage migration inhibitory factor revealed by ibudilast.

Authors:  Yoonsang Cho; Gregg V Crichlow; Jon J Vermeire; Lin Leng; Xin Du; Michael E Hodsdon; Richard Bucala; Michael Cappello; Matt Gross; Federico Gaeta; Kirk Johnson; Elias J Lolis
Journal:  Proc Natl Acad Sci U S A       Date:  2010-06-08       Impact factor: 11.205

2.  Analysis of weighted networks.

Authors:  M E J Newman
Journal:  Phys Rev E Stat Nonlin Soft Matter Phys       Date:  2004-11-24

3.  Generalized correlation for biomolecular dynamics.

Authors:  Oliver F Lange; Helmut Grubmüller
Journal:  Proteins       Date:  2006-03-01

4.  Structure of a trimeric domain of the MHC class II-associated chaperonin and targeting protein Ii.

Authors:  A Jasanoff; G Wagner; D C Wiley
Journal:  EMBO J       Date:  1998-12-01       Impact factor: 11.598

5.  Multiple binding modes of isothiocyanates that inhibit macrophage migration inhibitory factor.

Authors:  Emma S Spencer; Edward J Dale; Aimée L Gommans; Malcolm T Rutledge; Christine T Vo; Yoshio Nakatani; Allan B Gamble; Robin A J Smith; Sigurd M Wilbanks; Mark B Hampton; Joel D A Tyndall
Journal:  Eur J Med Chem       Date:  2015-02-24       Impact factor: 6.514

6.  Fragment screening of inhibitors for MIF tautomerase reveals a cryptic surface binding site.

Authors:  Larry R McLean; Ying Zhang; Hua Li; Yong-Mi Choi; Zuoning Han; Roy J Vaz; Yi Li
Journal:  Bioorg Med Chem Lett       Date:  2010-02-06       Impact factor: 2.823

7.  Dynamical networks in tRNA:protein complexes.

Authors:  Anurag Sethi; John Eargle; Alexis A Black; Zaida Luthey-Schulten
Journal:  Proc Natl Acad Sci U S A       Date:  2009-04-07       Impact factor: 11.205

8.  Detection of allosteric signal transmission by information-theoretic analysis of protein dynamics.

Authors:  Alessandro Pandini; Arianna Fornili; Franca Fraternali; Jens Kleinjung
Journal:  FASEB J       Date:  2011-11-09       Impact factor: 5.191

9.  MOLE 2.0: advanced approach for analysis of biomacromolecular channels.

Authors:  David Sehnal; Radka Svobodová Vařeková; Karel Berka; Lukáš Pravda; Veronika Navrátilová; Pavel Banáš; Crina-Maria Ionescu; Michal Otyepka; Jaroslav Koča
Journal:  J Cheminform       Date:  2013-08-16       Impact factor: 5.514

10.  Macrophage CD74 contributes to MIF-induced pulmonary inflammation.

Authors:  Koichiro Takahashi; Kiyokazu Koga; Helena M Linge; Yinzhong Zhang; Xinchun Lin; Christine N Metz; Yousef Al-Abed; Kaie Ojamaa; Edmund J Miller
Journal:  Respir Res       Date:  2009-05-04
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  10 in total

1.  Structural Plasticity in the C-Terminal Region of Macrophage Migration Inhibitory Factor-2 Is Associated with an Induced Fit Mechanism for a Selective Inhibitor.

Authors:  Georgios Pantouris; Richard Bucala; Elias J Lolis
Journal:  Biochemistry       Date:  2018-06-12       Impact factor: 3.162

2.  A selective small-molecule inhibitor of macrophage migration inhibitory factor-2 (MIF-2), a MIF cytokine superfamily member, inhibits MIF-2 biological activity.

Authors:  Pathricia Veronica Tilstam; Georgios Pantouris; Michael Corman; Monica Andreoli; Keyvan Mahboubi; Gary Davis; Xin Du; Lin Leng; Elias Lolis; Richard Bucala
Journal:  J Biol Chem       Date:  2019-10-02       Impact factor: 5.157

3.  Regulation of MIF Enzymatic Activity by an Allosteric Site at the Central Solvent Channel.

Authors:  Georgios Pantouris; Leepakshi Khurana; Anthony Ma; Erin Skeens; Krystle Reiss; Victor S Batista; George P Lisi; Elias J Lolis
Journal:  Cell Chem Biol       Date:  2020-05-19       Impact factor: 8.116

4.  The N-terminus of MIF regulates the dynamic profile of residues involved in CD74 activation.

Authors:  Andrew Parkins; Erin Skeens; C Michael McCallum; George P Lisi; Georgios Pantouris
Journal:  Biophys J       Date:  2021-08-24       Impact factor: 3.699

5.  Cross-Kingdom Analysis of Diversity, Evolutionary History, and Site Selection within the Eukaryotic Macrophage Migration Inhibitory Factor Superfamily.

Authors:  Claire Michelet; Etienne G J Danchin; Maelle Jaouannet; Jürgen Bernhagen; Ralph Panstruga; Karl-Heinz Kogel; Harald Keller; Christine Coustau
Journal:  Genes (Basel)       Date:  2019-09-24       Impact factor: 4.096

6.  Designed CXCR4 mimic acts as a soluble chemokine receptor that blocks atherogenic inflammation by agonist-specific targeting.

Authors:  Christos Kontos; Omar El Bounkari; Christine Krammer; Dzmitry Sinitski; Kathleen Hille; Chunfang Zan; Guangyao Yan; Sijia Wang; Ying Gao; Markus Brandhofer; Remco T A Megens; Adrian Hoffmann; Jessica Pauli; Yaw Asare; Simona Gerra; Priscila Bourilhon; Lin Leng; Hans-Henning Eckstein; Wolfgang E Kempf; Jaroslav Pelisek; Ozgun Gokce; Lars Maegdefessel; Richard Bucala; Martin Dichgans; Christian Weber; Aphrodite Kapurniotu; Jürgen Bernhagen
Journal:  Nat Commun       Date:  2020-11-25       Impact factor: 14.919

7.  Single-cell transcriptomics of murine mural cells reveals cellular heterogeneity.

Authors:  Ya-Na Guan; Yue Li; Moom Roosan; Qing Jing
Journal:  Sci China Life Sci       Date:  2020-11-03       Impact factor: 6.038

8.  A Cysteine Variant at an Allosteric Site Alters MIF Dynamics and Biological Function in Homo- and Heterotrimeric Assemblies.

Authors:  Erin Skeens; Georgios Pantouris; Dilip Shah; Ramu Manjula; Michael J Ombrello; N Karl Maluf; Vineet Bhandari; George P Lisi; Elias J Lolis
Journal:  Front Mol Biosci       Date:  2022-02-08

9.  Mechanism of allosteric activation of SIRT6 revealed by the action of rationally designed activators.

Authors:  Shaoyong Lu; Yingyi Chen; Jiacheng Wei; Mingzhu Zhao; Duan Ni; Xinheng He; Jian Zhang
Journal:  Acta Pharm Sin B       Date:  2020-09-19       Impact factor: 11.413

10.  Destabilization of macrophage migration inhibitory factor by 4-IPP reduces NF-κB/P-TEFb complex-mediated c-Myb transcription to suppress osteosarcoma tumourigenesis.

Authors:  Lin Zheng; Zhenhua Feng; Siyue Tao; Jiawei Gao; Ye Lin; Xiaoan Wei; Bingjie Zheng; Bao Huang; Zeyu Zheng; Xuyang Zhang; Junhui Liu; Zhi Shan; Yilei Chen; Jian Chen; Fengdong Zhao
Journal:  Clin Transl Med       Date:  2022-01
  10 in total

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