A Model of a MAPK•Substrate Complex in an Active Conformation: A Computational and Experimental Approach

• Sunbae Lee ,

  Contributed equally to this work with: Sunbae Lee, Mangalika Warthaka, Chunli Yan

  Affiliation Division of Medicinal Chemistry, University of Texas at Austin, Austin, Texas, United States of America

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• Mangalika Warthaka ,

  Contributed equally to this work with: Sunbae Lee, Mangalika Warthaka, Chunli Yan

  Affiliation Division of Medicinal Chemistry, University of Texas at Austin, Austin, Texas, United States of America

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• Chunli Yan ,

  Contributed equally to this work with: Sunbae Lee, Mangalika Warthaka, Chunli Yan

  Affiliation Department of Biomedical Engineering, University of Texas at Austin, Austin, Texas, United States of America

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• Tamer S. Kaoud,

  Affiliations Division of Medicinal Chemistry, University of Texas at Austin, Austin, Texas, United States of America, Graduate Program in Pharmacy, University of Texas at Austin, Austin, Texas, United States of America

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• Andrea Piserchio,

  Affiliation Department of Chemistry, The City College of New York, New York, New York, United States of America

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• Ranajeet Ghose,

  Affiliations Department of Chemistry, The City College of New York, New York, New York, United States of America, The Graduate Center of The City University of New York, New York, New York, United States of America

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• Pengyu Ren ,

  * E-mail: kinases@me.com (KND); pren@mail.utexas.edu (PR)

  Affiliations Department of Biomedical Engineering, University of Texas at Austin, Austin, Texas, United States of America, Graduate Program in Biomedical Engineering, University of Texas at Austin, Austin, Texas, United States of America

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• Kevin N. Dalby

  * E-mail: kinases@me.com (KND); pren@mail.utexas.edu (PR)

  Affiliations Division of Medicinal Chemistry, University of Texas at Austin, Austin, Texas, United States of America, Graduate Program in Pharmacy, University of Texas at Austin, Austin, Texas, United States of America, Graduate Program in Biomedical Engineering, University of Texas at Austin, Austin, Texas, United States of America, Graduate Program in Biochemistry, University of Texas at Austin, Austin, Texas, United States of America

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