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-Structure paper
Title | Predicting Residence Time and Drug Unbinding Pathway through Scaled Molecular Dynamics. |
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Journal, issue, pages | J. Chem. Inf. Model., Vol. 59, Page 535-549, Year 2019 |
Publish date | Aug 29, 2018 (structure data deposition date) |
![]() | Schuetz, D.A. / Bernetti, M. / Bertazzo, M. / Musil, D. / Eggenweiler, H.M. / Recanatini, M. / Masetti, M. / Ecker, G.F. / Cavalli, A. |
![]() | ![]() ![]() |
Methods | X-ray diffraction |
Resolution | 2 Å |
Structure data | ![]() PDB-6hhr: |
Chemicals | ![]() ChemComp-G5E: ![]() ChemComp-SO4: ![]() ChemComp-HOH: |
Source |
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![]() | CHAPERONE / ATP binding |