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-Structure paper
Title | Explicit Representation of Cation-pi Interactions in Force Fields with 1/r4 Nonbonded Terms. |
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Journal, issue, pages | J Chem Theory Comput, Vol. 16, Page 7184-7194, Year 2020 |
Publish date | Jun 24, 2020 (structure data deposition date) |
Authors | Turupcu, A. / Tirado-Rives, J. / Jorgensen, W.L. |
External links | J Chem Theory Comput / PubMed:33048555 |
Methods | X-ray diffraction |
Resolution | 2.02350796538 Å |
Structure data | PDB-6xjk: |
Chemicals | ChemComp-V4D: ChemComp-HOH: |
Source |
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Keywords | TRANSFERASE/INHIBITOR / PSEUDOKINASE DOMAIN / INHIBITOR / COMPLEX / TRANSFERASE / TRANSFERASE-INHIBITOR COMPLEX |