The binding sites of Mercury atom in the structure of Human Carbonic Anhydrase II Complexed With Two-Prong Inhibitors (pdb code 2fov). This binding sites where shown with 5.0 Angstroms radius around Mercury atom.
The 2fov structure was solved by K.M.JUDE, D.W.CHRISTIANSON, with X-Ray Crystallography technique, brief refinement statistics is given in the table below:
| Resolution (A) | 50.0-1.1 | | Space group | P1211 | | a (A) | 42.362 | | b (A) | 41.482 | | c (A) | 72.234 | | alpha (°) | 90.00 | | beta (°) | 104.34 | | gamma (°) | 90.00 | | Rfactor (%) | 14.3 | | Rfree (%) | 18.7 |
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Mercury binding site 1 out of 1 in 2fov
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Click to enlarge | Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Mercury in the PDB 2fov. Coordination sphere was calculated for all residues within 5.0 Angstroms distance from the central Mercury atom, shown by VdW sphere
Residues shown as a stick model or VDW spheres: A: Ala134, A: Val135, A: Gln136, A: Gln137, A: Pro138, A: Leu204, A: Glu205, A: Cmh206, A: Hoh414, A: Hoh444, A: Hoh503, | conact list:
| Atom | Atom | Distance (A) | | Hg | O A:Ala134 | 4.84 | | Hg | O A:Val135 | 3.42 | | Hg | C A:Val135 | 3.92 | | Hg | CA A:Val135 | 4.62 | | Hg | O A:Gln136 | 4.41 | | Hg | N A:Gln136 | 4.40 | | Hg | C A:Gln136 | 3.85 | | Hg | CA A:Gln136 | 4.27 | | Hg | O A:Gln137 | 2.99 | | Hg | N A:Gln137 | 3.51 | | Hg | C A:Gln137 | 3.45 | | Hg | CA A:Gln137 | 4.04 | | Hg | N A:Pro138 | 4.11 | | Hg | CA A:Pro138 | 4.35 | | Hg | CB A:Leu204 | 4.70 | | Hg | C A:Leu204 | 4.83 | | Hg | O A:Glu205 | 3.39 | | Hg | N A:Glu205 | 4.23 | | Hg | C A:Glu205 | 3.61 | | Hg | CA A:Glu205 | 4.51 | | Hg | HG A:Cmh206 | 0.00 | | Hg | CM A:Cmh206 | 1.99 | | Hg | N A:Cmh206 | 3.76 | | Hg | CB A:Cmh206 | 3.32 | | Hg | CB A:Cmh206 | 3.07 | | Hg | SG A:Cmh206 | 2.37 | | Hg | SG A:Cmh206 | 4.14 | | Hg | CA A:Cmh206 | 3.57 | | Hg | O A:Hoh414 | 4.54 | | Hg | O A:Hoh444 | 4.05 | | Hg | O A:Hoh503 | 3.04 |
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