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Atomistry » Chlorine » PDB 6erd-6ezo » 6ey9 | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Atomistry » Chlorine » PDB 6erd-6ezo » 6ey9 » |
Chlorine in PDB 6ey9: Estimation of Relative Drug-Target Residence Times By Random Acceleration Molecular Dynamics SimulationProtein crystallography data
The structure of Estimation of Relative Drug-Target Residence Times By Random Acceleration Molecular Dynamics Simulation, PDB code: 6ey9
was solved by
D.Musil,
M.Lehmann,
H.-P.Buchstaller,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Estimation of Relative Drug-Target Residence Times By Random Acceleration Molecular Dynamics Simulation
(pdb code 6ey9). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Estimation of Relative Drug-Target Residence Times By Random Acceleration Molecular Dynamics Simulation, PDB code: 6ey9: Chlorine binding site 1 out of 1 in 6ey9Go back to![]() ![]()
Chlorine binding site 1 out
of 1 in the Estimation of Relative Drug-Target Residence Times By Random Acceleration Molecular Dynamics Simulation
![]() Mono view ![]() Stereo pair view
Reference:
D.B.Kokh,
M.Amaral,
J.Bomke,
U.Gradler,
D.Musil,
H.P.Buchstaller,
M.K.Dreyer,
M.Frech,
M.Lowinski,
F.Vallee,
M.Bianciotto,
A.Rak,
R.C.Wade.
Estimation of Drug-Target Residence Times By Tau-Random Acceleration Molecular Dynamics Simulations. J Chem Theory Comput V. 14 3859 2018.
Page generated: Sat Jul 12 13:39:39 2025
ISSN: ISSN 1549-9626 PubMed: 29768913 DOI: 10.1021/ACS.JCTC.8B00230 |
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