4QFE
Crystal Structure of an Enoyl-CoA hydratase from Mycobacterium smegmatis
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0003824 | molecular_function | catalytic activity |
| A | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| A | 0006631 | biological_process | fatty acid metabolic process |
| B | 0003824 | molecular_function | catalytic activity |
| B | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| B | 0006631 | biological_process | fatty acid metabolic process |
| C | 0003824 | molecular_function | catalytic activity |
| C | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| C | 0006631 | biological_process | fatty acid metabolic process |
| D | 0003824 | molecular_function | catalytic activity |
| D | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| D | 0006631 | biological_process | fatty acid metabolic process |
| E | 0003824 | molecular_function | catalytic activity |
| E | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| E | 0006631 | biological_process | fatty acid metabolic process |
| F | 0003824 | molecular_function | catalytic activity |
| F | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| F | 0006631 | biological_process | fatty acid metabolic process |
| G | 0003824 | molecular_function | catalytic activity |
| G | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| G | 0006631 | biological_process | fatty acid metabolic process |
| H | 0003824 | molecular_function | catalytic activity |
| H | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| H | 0006631 | biological_process | fatty acid metabolic process |
| I | 0003824 | molecular_function | catalytic activity |
| I | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| I | 0006631 | biological_process | fatty acid metabolic process |
| J | 0003824 | molecular_function | catalytic activity |
| J | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| J | 0006631 | biological_process | fatty acid metabolic process |
| K | 0003824 | molecular_function | catalytic activity |
| K | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| K | 0006631 | biological_process | fatty acid metabolic process |
| L | 0003824 | molecular_function | catalytic activity |
| L | 0004300 | molecular_function | enoyl-CoA hydratase activity |
| L | 0006631 | biological_process | fatty acid metabolic process |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO A 301 |
| Chain | Residue |
| A | TYR103 |
| A | ASP123 |
| A | THR125 |
| B | ALA187 |
| site_id | AC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO A 302 |
| Chain | Residue |
| A | MET0 |
| A | SER2 |
| A | HOH526 |
| H | TYR170 |
| site_id | AC3 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO A 303 |
| Chain | Residue |
| A | LEU92 |
| A | TRP114 |
| A | ASP116 |
| A | ARG207 |
| A | HOH437 |
| A | HOH447 |
| A | MET90 |
| site_id | AC4 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO A 304 |
| Chain | Residue |
| A | GLU122 |
| A | VAL178 |
| A | VAL179 |
| A | PRO180 |
| A | HOH477 |
| A | HOH480 |
| site_id | AC5 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE NA A 305 |
| Chain | Residue |
| A | GLY215 |
| A | HOH548 |
| D | GLY215 |
| F | GLY215 |
| F | HOH482 |
| site_id | AC6 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EOH B 301 |
| Chain | Residue |
| B | ARG147 |
| B | LEU148 |
| B | HOH488 |
| site_id | AC7 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EDO B 302 |
| Chain | Residue |
| B | GLU218 |
| B | ASN219 |
| site_id | AC8 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO B 303 |
| Chain | Residue |
| B | MET90 |
| B | LEU92 |
| B | TRP114 |
| B | ASP116 |
| B | ARG207 |
| site_id | AC9 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE PO4 B 304 |
| Chain | Residue |
| B | ILE149 |
| B | GLY150 |
| B | HOH453 |
| E | ILE149 |
| H | ILE149 |
| H | GLY150 |
| site_id | BC1 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE NA B 305 |
| Chain | Residue |
| B | GLY215 |
| B | HOH460 |
| B | HOH519 |
| E | GLY215 |
| H | GLY215 |
| site_id | BC2 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO E 301 |
| Chain | Residue |
| E | LEU92 |
| E | VAL96 |
| E | TRP114 |
| E | ASP116 |
| E | ARG207 |
| E | HOH439 |
| E | HOH476 |
| site_id | BC3 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO F 301 |
| Chain | Residue |
| A | ARG162 |
| A | GLU168 |
| F | TYR170 |
| site_id | BC4 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO F 302 |
| Chain | Residue |
| E | VAL1 |
| F | GLU122 |
| F | VAL178 |
| site_id | BC5 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO G 301 |
| Chain | Residue |
| B | TYR103 |
| B | VAL105 |
| B | PHE129 |
| B | TRP133 |
| G | GLN186 |
| G | GLU189 |
| G | HOH457 |
| site_id | BC6 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO G 302 |
| Chain | Residue |
| B | PHE129 |
| G | ARG185 |
| G | HOH421 |
| G | HOH429 |
| site_id | BC7 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO G 303 |
| Chain | Residue |
| G | MET90 |
| G | LEU92 |
| G | TRP114 |
| G | ASP116 |
| G | ARG207 |
| G | HOH475 |
| site_id | BC8 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NA G 304 |
| Chain | Residue |
| G | GLY215 |
| I | GLY215 |
| L | GLY215 |
| L | HOH403 |
| site_id | BC9 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE PO4 G 305 |
| Chain | Residue |
| G | ILE149 |
| G | GLY150 |
| G | HOH518 |
| I | ILE149 |
| I | GLY150 |
| L | ILE149 |
| L | GLY150 |
| site_id | CC1 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE PO4 H 301 |
| Chain | Residue |
| A | SER-1 |
| E | ARG162 |
| E | GLU168 |
| H | TYR170 |
| H | ARG177 |
| site_id | CC2 |
| Number of Residues | 2 |
| Details | BINDING SITE FOR RESIDUE EOH I 301 |
| Chain | Residue |
| I | PRO30 |
| I | HOH480 |
| site_id | CC3 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO I 302 |
| Chain | Residue |
| I | ASN57 |
| J | ARG162 |
| J | GLU168 |
| K | TYR170 |
| site_id | CC4 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO I 303 |
| Chain | Residue |
| I | MET90 |
| I | ASP91 |
| I | LEU92 |
| I | TRP114 |
| I | ASP116 |
| I | ARG207 |
| site_id | CC5 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO I 304 |
| Chain | Residue |
| G | ARG177 |
| I | ARG162 |
| I | HOH441 |
| I | HOH509 |
| I | HOH521 |
| site_id | CC6 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO I 305 |
| Chain | Residue |
| I | TYR170 |
| I | ARG177 |
| I | VAL178 |
| I | HOH511 |
| site_id | CC7 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO I 306 |
| Chain | Residue |
| I | ARG144 |
| I | LEU148 |
| I | HOH405 |
| I | HOH411 |
| I | HOH524 |
| site_id | CC8 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO I 307 |
| Chain | Residue |
| I | ARG20 |
| I | PRO21 |
| I | GLU22 |
| I | ALA23 |
| I | HOH462 |
| I | HOH467 |
| site_id | CC9 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO J 301 |
| Chain | Residue |
| J | ARG24 |
| J | ALA62 |
| J | TYR103 |
| J | HOH414 |
| J | HOH515 |
| J | HOH516 |
| site_id | DC1 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO J 302 |
| Chain | Residue |
| J | MET90 |
| J | LEU92 |
| J | TRP114 |
| J | ASP116 |
| J | ARG207 |
| J | HOH524 |
| J | HOH536 |
| site_id | DC2 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO J 303 |
| Chain | Residue |
| I | GLU22 |
| J | ARG153 |
| J | GLU168 |
| J | ILE172 |
| J | HOH455 |
| K | TYR170 |
| K | ASN176 |
| K | HOH418 |
| site_id | DC3 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO J 304 |
| Chain | Residue |
| C | HIS151 |
| J | LEU113 |
| J | ARG144 |
| J | LEU148 |
| J | HOH416 |
| J | HOH453 |
| J | HOH501 |
| site_id | DC4 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO J 305 |
| Chain | Residue |
| D | VAL105 |
| D | PHE129 |
| J | ARG185 |
| J | GLN186 |
| J | GLU189 |
| J | HOH544 |
| site_id | DC5 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE EDO J 306 |
| Chain | Residue |
| J | ARG177 |
| J | LEU191 |
| J | HOH499 |
| site_id | DC6 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE NA J 307 |
| Chain | Residue |
| C | GLY215 |
| C | HOH403 |
| J | GLY215 |
| J | HOH533 |
| K | GLY215 |
| site_id | DC7 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO C 301 |
| Chain | Residue |
| C | ARG162 |
| C | HOH404 |
| J | TYR170 |
| J | ARG177 |
| site_id | DC8 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO C 302 |
| Chain | Residue |
| C | ILE149 |
| C | GLY150 |
| C | HOH427 |
| C | HOH493 |
| J | ILE149 |
| J | GLY150 |
| K | ILE149 |
| K | GLY150 |
| site_id | DC9 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE PO4 D 301 |
| Chain | Residue |
| A | ILE149 |
| A | GLY150 |
| D | ILE149 |
| D | GLY150 |
| D | HOH401 |
| D | HOH504 |
| F | ILE149 |
| F | GLY150 |
| site_id | EC1 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO D 302 |
| Chain | Residue |
| A | TYR170 |
| D | ARG162 |
| D | GLU168 |
| D | HOH444 |
| D | HOH525 |
| site_id | EC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE EDO K 301 |
| Chain | Residue |
| B | GLU73 |
| K | ARG6 |
| K | GLU8 |
| K | ARG185 |
| site_id | EC3 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO K 302 |
| Chain | Residue |
| K | LEU92 |
| K | VAL96 |
| K | TRP114 |
| K | ASP116 |
| K | ARG207 |
| K | HOH461 |
| K | HOH496 |
| site_id | EC4 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO K 303 |
| Chain | Residue |
| J | HIS151 |
| K | LEU113 |
| K | ARG144 |
| K | LEU148 |
| K | HOH428 |
| K | HOH458 |
| K | HOH500 |
| site_id | EC5 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO L 301 |
| Chain | Residue |
| L | LEU113 |
| L | ARG144 |
| L | TRP214 |
| L | HOH411 |
| L | HOH466 |
| site_id | EC6 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO L 302 |
| Chain | Residue |
| L | MET90 |
| L | LEU92 |
| L | TRP114 |
| L | ASP116 |
| L | ARG207 |
| L | HOH435 |
Functional Information from PROSITE/UniProt
| site_id | PS00166 |
| Number of Residues | 21 |
| Details | ENOYL_COA_HYDRATASE Enoyl-CoA hydratase/isomerase signature. IAaISGyavAGGlelaLwCDL |
| Chain | Residue | Details |
| A | ILE97-LEU117 |
