Molecular dynamics simulation data of regulatory ACT domain dimer of human phenylalanine hydroxylase (PAH)
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https://zenodo.org/record/3780205
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资源简介：
Raw data of molecular dynamics simulations of regulatory ACT domain dimer.
binding.zip: simulation starting from 21 dimer conformations with 19 Phe ligand
bound.zip: simulation starting from dimer with bound Phe ligand
dimer.zip: simulation starting from 21 dimer conformations simulation
Simulation setup files are also included in each folder.
Details can be found in this paper:
Yunhui Ge, Elias Borne, Shannon Stewart, Michael R. Hansen, Emilia C. Arturo, Eileen K. Jaffe and Vincent A. Voelz. Simulation of the regulatory ACT domain of human PAH unveil the mechanism of phenylalanine binding. J. Biol. Chem., 2018, 293(51), pp 19532-19543
创建时间：
2020-05-03
