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Crystal structure of GSK-3B in complex with pyrazine inhibitor C50

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Protein Data Bank Japan2024-11-13 更新2026-03-21 收录
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Crystal structure of GSK-3B in complex with pyrazine inhibitor C50 Descriptor: 3-azanyl-~{N}-(2-methoxyethyl)-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]pyrazine-2-carboxamide, DIMETHYL SULFOXIDE, GLYCEROL, ... Authors: Piretti, V, Giabbai, B, Demitri, N, Di Martino, R, Tripathi, S.K, Gobbo, D, Decherchi, S, Storici, P, Girotto, S, Cavalli, A. Deposit date: 2018-09-05 Release date: 2019-07-17 Last modified: 2024-11-13 Method: X-RAY DIFFRACTION (3.2 Å) Cite: Investigating Drug-Target Residence Time in Kinases through Enhanced Sampling Simulations. J Chem Theory Comput, 15, 2019
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2018-09-05
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