2C3K
Identification of a buried pocket for potent and selective inhibition of Chk1: prediction and verification
Summary for 2C3K
Entry DOI | 10.2210/pdb2c3k/pdb |
Related | 1IA8 1NVQ 1NVR 1NVS 2BR1 2BRB 2BRG 2BRH 2BRM 2BRN 2BRO 2C3J 2C3L |
Descriptor | SERINE/THREONINE-PROTEIN KINASE CHK1, 4-[3-(1H-BENZIMIDAZOL-2-YL)-1H-INDAZOL-6-YL]-2-METHOXYPHENOL (3 entities in total) |
Functional Keywords | drug design, molecular modeling, molecular recognition, oncology, atp-binding, cell cycle, dna damage, dna repair, kinase, nuclear protein, nucleotide-binding, phosphorylation, polymorphism, serine/threonine-protein kinase, transferase, ubl conjugation |
Biological source | HOMO SAPIENS (HUMAN) |
Total number of polymer chains | 1 |
Total formula weight | 34504.53 |
Authors | Foloppe, N.,Fisher, L.M.,Francis, G.,Howes, R.,Kierstan, P.,Potter, A. (deposition date: 2005-10-10, release date: 2005-11-23, Last modification date: 2023-12-13) |
Primary citation | Foloppe, N.,Fisher, L.M.,Francis, G.,Howes, R.,Kierstan, P.,Potter, A. Identification of a Buried Pocket for Potent and Selective Inhibition of Chk1: Prediction and Verification. Bioorg.Med.Chem., 14:1792-, 2006 Cited by PubMed: 16289938DOI: 10.1016/J.BMC.2005.10.022 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.6 Å) |
Structure validation
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