mm:parameters:iron:cccc
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mm:parameters:iron:cccc [2013/08/05 18:53] ruineves |
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| ====== Iron(III) - CCCC ====== | ====== Iron(III) - CCCC ====== | ||
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| + | Rubredoxin is a mononuclear iron tetrahedral metal center coordinated with four cysteines that are not directly connected in the backbone of the protein. | ||
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| - | + | | **COORDINATION SPHERE** || | |
| - | + | | {{ :mm:parameters:iron:cccc_non-parameterized.png?120|}} | \\ **Oxidation State:** Fe(III) \\ **Spin Multiplicity:** 6 | | |
| - | | **Coordination Sphere** | **Oxidation State:** Fe(III) \\ **Spin Multiplicity:** 6 | | + | |
| - | | {{ :mm:parameters:iron:cccc_non-parameterized.png?200|}} | PATH TO IMAGE2 ((The schemes represent geometrical dispositions for crystal lattices. These should be roughly similar to the corresponding distorted geometries in enzymatic coordination spheres.)) | | + | |
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| ===== References ===== | ===== References ===== | ||
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| A.T.P. Carvalho, A.F.S. Teixeira, MJ.Ramos. [[http://onlinelibrary.wiley.com/doi/10.1002/jcc.23287/abstract;jsessionid=415EECAA000727C4BCBA82544438C428.d03t02 | Parameters for Molecular Dynamics Simulations of Iron-Sulfur Proteins]]. //J. Comput. Chem.//, **2013**, 34, 1540-1548 | A.T.P. Carvalho, A.F.S. Teixeira, MJ.Ramos. [[http://onlinelibrary.wiley.com/doi/10.1002/jcc.23287/abstract;jsessionid=415EECAA000727C4BCBA82544438C428.d03t02 | Parameters for Molecular Dynamics Simulations of Iron-Sulfur Proteins]]. //J. Comput. Chem.//, **2013**, 34, 1540-1548 | ||
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| D. A. Giammona, //Ph.D. Thesis//; University of California: Davis, **1984** | D. A. Giammona, //Ph.D. Thesis//; University of California: Davis, **1984** | ||
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mm/parameters/iron/cccc.1375725195.txt.gz · Last modified: 2013/08/05 18:53 by ruineves
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