Reconciling ASPP-p53 binding mode discrepancies through an ensemble binding framework that bridges crystallography and NMR data

• Te Liu,

  Roles Data curation, Formal analysis, Investigation, Writing – original draft

  Affiliation Research Center for Pharmacoinformatics, College of Pharmacy, Harbin Medical University, Harbin, China

  https://orcid.org/0009-0002-3205-0988

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• Sichao Huang,

  Roles Data curation, Methodology, Software

  Affiliation Research Center for Pharmacoinformatics, College of Pharmacy, Harbin Medical University, Harbin, China

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• Qian Zhang,

  Roles Methodology, Resources, Software

  Affiliation Research Center for Pharmacoinformatics, College of Pharmacy, Harbin Medical University, Harbin, China

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• Yu Xia,

  Roles Methodology, Software

  Affiliation Research Center for Pharmacoinformatics, College of Pharmacy, Harbin Medical University, Harbin, China

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• Manjie Zhang ,

  Roles Conceptualization, Funding acquisition, Project administration, Supervision, Writing – review & editing

  * E-mail: zhangmj454@nenu.edu.cn (MZ); binsun@hrbmu.edu.cn (BS)

  Affiliation Research Center for Pharmacoinformatics, College of Pharmacy, Harbin Medical University, Harbin, China

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• Bin Sun

  Roles Conceptualization, Funding acquisition, Investigation, Methodology, Project administration, Supervision, Validation, Writing – original draft, Writing – review & editing

  * E-mail: zhangmj454@nenu.edu.cn (MZ); binsun@hrbmu.edu.cn (BS)

  Affiliation Research Center for Pharmacoinformatics, College of Pharmacy, Harbin Medical University, Harbin, China

  https://orcid.org/0000-0003-2583-4493

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