5A13
Crystal structure of Chlorite Dismutase from Magnetospirillum sp. in complex with thiocyanate
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0016491 | molecular_function | oxidoreductase activity |
| A | 0020037 | molecular_function | heme binding |
| A | 0046872 | molecular_function | metal ion binding |
| A | 0050587 | molecular_function | chlorite O2-lyase activity |
| B | 0016491 | molecular_function | oxidoreductase activity |
| B | 0020037 | molecular_function | heme binding |
| B | 0046872 | molecular_function | metal ion binding |
| B | 0050587 | molecular_function | chlorite O2-lyase activity |
| C | 0016491 | molecular_function | oxidoreductase activity |
| C | 0020037 | molecular_function | heme binding |
| C | 0046872 | molecular_function | metal ion binding |
| C | 0050587 | molecular_function | chlorite O2-lyase activity |
| D | 0016491 | molecular_function | oxidoreductase activity |
| D | 0020037 | molecular_function | heme binding |
| D | 0046872 | molecular_function | metal ion binding |
| D | 0050587 | molecular_function | chlorite O2-lyase activity |
| E | 0016491 | molecular_function | oxidoreductase activity |
| E | 0020037 | molecular_function | heme binding |
| E | 0046872 | molecular_function | metal ion binding |
| E | 0050587 | molecular_function | chlorite O2-lyase activity |
| F | 0016491 | molecular_function | oxidoreductase activity |
| F | 0020037 | molecular_function | heme binding |
| F | 0046872 | molecular_function | metal ion binding |
| F | 0050587 | molecular_function | chlorite O2-lyase activity |
| G | 0016491 | molecular_function | oxidoreductase activity |
| G | 0020037 | molecular_function | heme binding |
| G | 0046872 | molecular_function | metal ion binding |
| G | 0050587 | molecular_function | chlorite O2-lyase activity |
| H | 0016491 | molecular_function | oxidoreductase activity |
| H | 0020037 | molecular_function | heme binding |
| H | 0046872 | molecular_function | metal ion binding |
| H | 0050587 | molecular_function | chlorite O2-lyase activity |
| I | 0016491 | molecular_function | oxidoreductase activity |
| I | 0020037 | molecular_function | heme binding |
| I | 0046872 | molecular_function | metal ion binding |
| I | 0050587 | molecular_function | chlorite O2-lyase activity |
| J | 0016491 | molecular_function | oxidoreductase activity |
| J | 0020037 | molecular_function | heme binding |
| J | 0046872 | molecular_function | metal ion binding |
| J | 0050587 | molecular_function | chlorite O2-lyase activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE HEM A 250 |
| Chain | Residue |
| A | LEU116 |
| A | THR174 |
| A | LEU178 |
| A | ARG183 |
| A | PHE196 |
| A | PHE200 |
| A | LEU211 |
| A | LEU212 |
| A | LEU215 |
| A | SCN251 |
| A | HOH2114 |
| A | ASN117 |
| A | HOH2121 |
| A | HOH2122 |
| A | HOH2230 |
| A | TYR118 |
| A | ILE119 |
| A | LEU131 |
| A | LYS151 |
| A | TRP155 |
| A | HIS170 |
| A | THR171 |
| site_id | AC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN A 251 |
| Chain | Residue |
| A | ARG183 |
| A | LYS184 |
| A | LEU185 |
| A | HEM250 |
| site_id | AC3 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE GOL A 252 |
| Chain | Residue |
| A | THR16 |
| A | THR17 |
| A | PRO18 |
| A | THR113 |
| A | LYS114 |
| A | LYS184 |
| A | HOH2014 |
| A | HOH2113 |
| A | HOH2184 |
| site_id | AC4 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE HEM B 250 |
| Chain | Residue |
| B | LEU116 |
| B | ASN117 |
| B | TYR118 |
| B | ILE119 |
| B | LYS151 |
| B | TRP155 |
| B | HIS170 |
| B | THR171 |
| B | THR174 |
| B | ARG183 |
| B | PHE196 |
| B | THR198 |
| B | PHE200 |
| B | LEU211 |
| B | LEU212 |
| B | LEU215 |
| B | TRP227 |
| B | SCN251 |
| B | HOH2118 |
| B | HOH2124 |
| B | HOH2125 |
| B | HOH2233 |
| site_id | AC5 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN B 251 |
| Chain | Residue |
| B | ARG183 |
| B | LYS184 |
| B | LEU185 |
| B | HEM250 |
| site_id | AC6 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE GOL B 252 |
| Chain | Residue |
| B | THR16 |
| B | THR113 |
| B | LYS114 |
| B | LYS184 |
| B | HOH2019 |
| B | HOH2117 |
| B | HOH2181 |
| site_id | AC7 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE HEM C 250 |
| Chain | Residue |
| C | LEU116 |
| C | ASN117 |
| C | TYR118 |
| C | ILE119 |
| C | LYS151 |
| C | TRP155 |
| C | HIS170 |
| C | THR171 |
| C | THR174 |
| C | ARG183 |
| C | PHE196 |
| C | THR198 |
| C | PHE200 |
| C | LEU212 |
| C | LEU215 |
| C | TRP227 |
| C | SCN251 |
| C | HOH2123 |
| C | HOH2131 |
| C | HOH2132 |
| C | HOH2133 |
| site_id | AC8 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE SCN C 251 |
| Chain | Residue |
| C | LYS184 |
| C | LEU185 |
| C | HEM250 |
| site_id | AC9 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE GOL C 252 |
| Chain | Residue |
| C | HOH2124 |
| C | HOH2189 |
| C | HOH2237 |
| C | THR16 |
| C | THR17 |
| C | PRO18 |
| C | THR113 |
| C | LYS114 |
| C | LYS184 |
| C | HOH2013 |
| site_id | BC1 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE GOL C 253 |
| Chain | Residue |
| C | MET34 |
| C | ARG67 |
| C | THR245 |
| C | GLY248 |
| C | HOH2238 |
| C | HOH2239 |
| E | VAL92 |
| E | ARG95 |
| site_id | BC2 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE HEM D 250 |
| Chain | Residue |
| D | LEU116 |
| D | ASN117 |
| D | TYR118 |
| D | ILE119 |
| D | LYS151 |
| D | TRP155 |
| D | HIS170 |
| D | THR171 |
| D | THR174 |
| D | ARG183 |
| D | PHE196 |
| D | PHE200 |
| D | LEU211 |
| D | LEU212 |
| D | LEU215 |
| D | TRP227 |
| D | SCN251 |
| D | HOH2083 |
| D | HOH2087 |
| D | HOH2088 |
| D | HOH2089 |
| D | HOH2141 |
| site_id | BC3 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN D 251 |
| Chain | Residue |
| D | ARG183 |
| D | LYS184 |
| D | LEU185 |
| D | HEM250 |
| site_id | BC4 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE GOL D 252 |
| Chain | Residue |
| D | THR16 |
| D | THR17 |
| D | PRO18 |
| D | THR113 |
| D | LYS114 |
| D | LYS184 |
| D | HOH2080 |
| D | HOH2129 |
| site_id | BC5 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE GOL D 253 |
| Chain | Residue |
| A | MET34 |
| A | ARG67 |
| A | THR245 |
| A | GLY248 |
| D | VAL92 |
| D | ARG95 |
| D | HOH2074 |
| D | HOH2156 |
| site_id | BC6 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE HEM E 250 |
| Chain | Residue |
| E | LEU116 |
| E | ASN117 |
| E | TYR118 |
| E | ILE119 |
| E | LYS151 |
| E | TRP155 |
| E | HIS170 |
| E | THR171 |
| E | THR174 |
| E | ARG183 |
| E | PHE196 |
| E | THR198 |
| E | PHE200 |
| E | LEU211 |
| E | LEU212 |
| E | LEU215 |
| E | SCN251 |
| E | HOH2078 |
| E | HOH2083 |
| E | HOH2084 |
| E | HOH2199 |
| site_id | BC7 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN E 251 |
| Chain | Residue |
| E | ARG183 |
| E | LYS184 |
| E | LEU185 |
| E | HEM250 |
| site_id | BC8 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE GOL E 252 |
| Chain | Residue |
| E | THR16 |
| E | THR17 |
| E | PRO18 |
| E | THR113 |
| E | LYS114 |
| E | LYS184 |
| E | HOH2012 |
| E | HOH2077 |
| E | HOH2157 |
| site_id | BC9 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE HEM F 250 |
| Chain | Residue |
| F | LEU116 |
| F | ASN117 |
| F | TYR118 |
| F | ILE119 |
| F | LYS151 |
| F | TRP155 |
| F | HIS170 |
| F | THR171 |
| F | THR174 |
| F | ARG183 |
| F | PHE196 |
| F | THR198 |
| F | PHE200 |
| F | LEU211 |
| F | LEU212 |
| F | LEU215 |
| F | TRP227 |
| F | SCN251 |
| F | HOH2123 |
| F | HOH2131 |
| F | HOH2133 |
| F | HOH2246 |
| site_id | CC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN F 251 |
| Chain | Residue |
| F | ARG183 |
| F | LYS184 |
| F | LEU185 |
| F | HEM250 |
| site_id | CC2 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE GOL F 252 |
| Chain | Residue |
| F | THR16 |
| F | THR17 |
| F | PRO18 |
| F | THR113 |
| F | LYS114 |
| F | LYS184 |
| F | HOH2124 |
| F | HOH2196 |
| site_id | CC3 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE HEM G 250 |
| Chain | Residue |
| G | LEU116 |
| G | ASN117 |
| G | TYR118 |
| G | ILE119 |
| G | ILE147 |
| G | LYS151 |
| G | TRP155 |
| G | HIS170 |
| G | THR171 |
| G | THR174 |
| G | ARG183 |
| G | PHE196 |
| G | PHE200 |
| G | LEU211 |
| G | LEU212 |
| G | LEU215 |
| G | TRP227 |
| G | SCN251 |
| G | HOH2112 |
| G | HOH2120 |
| G | HOH2121 |
| G | HOH2229 |
| site_id | CC4 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN G 251 |
| Chain | Residue |
| G | ARG183 |
| G | LYS184 |
| G | LEU185 |
| G | HEM250 |
| site_id | CC5 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE GOL G 252 |
| Chain | Residue |
| G | THR16 |
| G | THR17 |
| G | PRO18 |
| G | THR113 |
| G | LYS114 |
| G | LYS184 |
| G | HOH2013 |
| G | HOH2113 |
| G | HOH2176 |
| site_id | CC6 |
| Number of Residues | 23 |
| Details | BINDING SITE FOR RESIDUE HEM H 250 |
| Chain | Residue |
| H | LEU116 |
| H | ASN117 |
| H | TYR118 |
| H | ILE119 |
| H | LYS151 |
| H | TRP155 |
| H | ILE167 |
| H | HIS170 |
| H | THR171 |
| H | THR174 |
| H | LEU178 |
| H | ARG183 |
| H | PHE196 |
| H | PHE200 |
| H | LEU211 |
| H | LEU212 |
| H | LEU215 |
| H | TRP227 |
| H | SCN251 |
| H | HOH2103 |
| H | HOH2108 |
| H | HOH2109 |
| H | HOH2200 |
| site_id | CC7 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN H 251 |
| Chain | Residue |
| H | ARG183 |
| H | LYS184 |
| H | LEU185 |
| H | HEM250 |
| site_id | CC8 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE GOL H 252 |
| Chain | Residue |
| H | THR16 |
| H | THR17 |
| H | PRO18 |
| H | THR113 |
| H | LYS114 |
| H | LYS184 |
| H | HOH2008 |
| H | HOH2102 |
| H | HOH2158 |
| site_id | CC9 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE GOL H 253 |
| Chain | Residue |
| H | MET34 |
| H | ARG67 |
| H | THR245 |
| H | GLY248 |
| H | HOH2070 |
| H | HOH2201 |
| H | HOH2202 |
| J | VAL92 |
| J | ARG95 |
| site_id | DC1 |
| Number of Residues | 23 |
| Details | BINDING SITE FOR RESIDUE HEM I 250 |
| Chain | Residue |
| I | LEU116 |
| I | ASN117 |
| I | TYR118 |
| I | ILE119 |
| I | LYS151 |
| I | TRP155 |
| I | ILE167 |
| I | HIS170 |
| I | THR171 |
| I | THR174 |
| I | ARG183 |
| I | PHE196 |
| I | THR198 |
| I | PHE200 |
| I | LEU211 |
| I | LEU212 |
| I | LEU215 |
| I | TRP227 |
| I | SCN251 |
| I | HOH2080 |
| I | HOH2087 |
| I | HOH2088 |
| I | HOH2089 |
| site_id | DC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN I 251 |
| Chain | Residue |
| I | ARG183 |
| I | LYS184 |
| I | LEU185 |
| I | HEM250 |
| site_id | DC3 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE GOL I 252 |
| Chain | Residue |
| I | THR16 |
| I | THR17 |
| I | PRO18 |
| I | THR113 |
| I | LYS114 |
| I | LYS184 |
| I | HOH2081 |
| I | HOH2141 |
| site_id | DC4 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE GOL I 253 |
| Chain | Residue |
| G | VAL92 |
| G | ARG95 |
| G | ALA96 |
| G | HOH2099 |
| I | MET34 |
| I | ARG67 |
| I | THR245 |
| I | GLY248 |
| I | HOH2059 |
| I | HOH2174 |
| site_id | DC5 |
| Number of Residues | 22 |
| Details | BINDING SITE FOR RESIDUE HEM J 250 |
| Chain | Residue |
| J | LEU116 |
| J | ASN117 |
| J | TYR118 |
| J | ILE119 |
| J | LYS151 |
| J | TRP155 |
| J | HIS170 |
| J | THR171 |
| J | THR174 |
| J | ARG183 |
| J | PHE196 |
| J | THR198 |
| J | PHE200 |
| J | LEU211 |
| J | LEU212 |
| J | LEU215 |
| J | TRP227 |
| J | SCN251 |
| J | HOH2071 |
| J | HOH2078 |
| J | HOH2080 |
| J | HOH2175 |
| site_id | DC6 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SCN J 251 |
| Chain | Residue |
| J | ARG183 |
| J | LYS184 |
| J | LEU185 |
| J | HEM250 |
| site_id | DC7 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE GOL J 252 |
| Chain | Residue |
| J | THR16 |
| J | THR17 |
| J | PRO18 |
| J | THR113 |
| J | LYS114 |
| J | LYS184 |
| J | HOH2008 |
| J | HOH2072 |
| J | HOH2138 |
