6XJK
JAK2 JH2 in complex with JAK067
Summary for 6XJK
| Entry DOI | 10.2210/pdb6xjk/pdb |
| Descriptor | Tyrosine-protein kinase JAK2, 4-({4-amino-6-[(1H-indol-5-yl)oxy]-1,3,5-triazin-2-yl}amino)benzene-1-sulfonamide (3 entities in total) |
| Functional Keywords | pseudokinase domain, inhibitor, complex, transferase, transferase-inhibitor complex, transferase/inhibitor |
| Biological source | Homo sapiens (Human) |
| Total number of polymer chains | 1 |
| Total formula weight | 33518.37 |
| Authors | Puleo, D.E.,Krimmer, S.G.,Newton, A.S.,Schlessinger, J.,Jorgensen, W.L. (deposition date: 2020-06-24, release date: 2020-11-25, Last modification date: 2023-10-18) |
| Primary citation | Turupcu, A.,Tirado-Rives, J.,Jorgensen, W.L. Explicit Representation of Cation-pi Interactions in Force Fields with 1/r4 Nonbonded Terms. J Chem Theory Comput, 16:7184-7194, 2020 Cited by PubMed: 33048555DOI: 10.1021/acs.jctc.0c00847 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (2.02350796538 Å) |
Structure validation
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