Ion mobility mass spectrometry and molecular dynamics simulations unravel the conformational stability and coordination dynamics of human metallothionein-2 species
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OA: closed
CC-BY-NC-4.0
Abstract
Ion mobility-mass spectrometry (IM-MS) unraveled different conformational stability in Zn 4-7 -metallothionein-2. We introduced a new molecular dynamics simulations approach that permitted the exploration of all conformational space confirming the experimental data, and revealed that not only the Zn–S bonds but also α–β domain interaction modulates protein unfolding.
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- europepmc
- last seen: 2026-05-19T01:45:01.086888+00:00
- unpaywall
- last seen: 2026-05-22T02:00:06.705733+00:00
License: CC-BY-NC-4.0