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Crystal structure of selective inhibitor 16 bound at the active site of CDK1

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Protein Data Bank Japan2026-07-22 更新2026-08-02 收录
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Crystal structure of selective inhibitor 16 bound at the active site of CDK1 Descriptor: (1R,3S)-3-{3-[(1-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)amino]-1H-pyrazol-5-yl}cyclopentyl bicyclo[1.1.1]pentan-1-ylcarbamate, (6S,9R,13S)-6,9-dimethyl-2,5,8,11-tetraoxatetradecan-13-amine, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ... Authors: Murray, J.M, Oh, A, Kiefer, J.R, Verma, V.A, Grandner, J.M, Parr, B.T. Deposit date: 2026-02-23 Release date: 2026-07-08 Last modified: 2026-07-22 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Utilizing Molecular Dynamics and Mechanistic Pharmacokinetic Studies in the Design of Selective CDK2 Inhibitors. J.Med.Chem., 69, 2026

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2026-02-23
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