3F4B
Crystal structure of Plasmodium berghei Enoyl-acyl-carrier-protein reductase with TRICLOSAN
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004318 | molecular_function | enoyl-[acyl-carrier-protein] reductase (NADH) activity |
| A | 0006633 | biological_process | fatty acid biosynthetic process |
| B | 0004318 | molecular_function | enoyl-[acyl-carrier-protein] reductase (NADH) activity |
| B | 0006633 | biological_process | fatty acid biosynthetic process |
| C | 0004318 | molecular_function | enoyl-[acyl-carrier-protein] reductase (NADH) activity |
| C | 0006633 | biological_process | fatty acid biosynthetic process |
| D | 0004318 | molecular_function | enoyl-[acyl-carrier-protein] reductase (NADH) activity |
| D | 0006633 | biological_process | fatty acid biosynthetic process |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 30 |
| Details | BINDING SITE FOR RESIDUE NAD A 450 |
| Chain | Residue |
| A | HOH30 |
| A | ASP153 |
| A | ALA154 |
| A | SER200 |
| A | LEU201 |
| A | ALA202 |
| A | ASN203 |
| A | LEU250 |
| A | THR251 |
| A | LYS270 |
| A | ALA297 |
| A | HOH58 |
| A | GLY298 |
| A | PRO299 |
| A | LEU300 |
| A | SER302 |
| A | ARG303 |
| A | ALA304 |
| A | TCL400 |
| A | HOH418 |
| A | HOH421 |
| A | HOH441 |
| A | GLY87 |
| A | HOH454 |
| A | VAL88 |
| A | GLY89 |
| A | GLY93 |
| A | TYR94 |
| A | TRP114 |
| A | LEU152 |
| site_id | AC2 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE TCL A 400 |
| Chain | Residue |
| A | ALA202 |
| A | GLY204 |
| A | TYR252 |
| A | TYR262 |
| A | LYS270 |
| A | ALA304 |
| A | ALA305 |
| A | ILE308 |
| A | NAD450 |
| site_id | AC3 |
| Number of Residues | 29 |
| Details | BINDING SITE FOR RESIDUE NAD D 550 |
| Chain | Residue |
| D | HOH45 |
| D | GLY87 |
| D | GLY89 |
| D | GLY93 |
| D | TYR94 |
| D | TRP114 |
| D | LEU152 |
| D | ASP153 |
| D | ALA154 |
| D | SER200 |
| D | LEU201 |
| D | ALA202 |
| D | ASN203 |
| D | LYS225 |
| D | LEU250 |
| D | THR251 |
| D | LYS270 |
| D | ALA297 |
| D | GLY298 |
| D | PRO299 |
| D | LEU300 |
| D | SER302 |
| D | ALA304 |
| D | HOH401 |
| D | HOH413 |
| D | HOH438 |
| D | HOH441 |
| D | HOH443 |
| D | TCL500 |
| site_id | AC4 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE TCL D 500 |
| Chain | Residue |
| D | ALA202 |
| D | ASN203 |
| D | GLY204 |
| D | TYR252 |
| D | TYR262 |
| D | ALA304 |
| D | NAD550 |
| site_id | AC5 |
| Number of Residues | 27 |
| Details | BINDING SITE FOR RESIDUE NAD C 450 |
| Chain | Residue |
| C | HOH411 |
| C | HOH431 |
| C | HOH440 |
| C | HOH44 |
| C | GLY87 |
| C | VAL88 |
| C | GLY89 |
| C | GLY93 |
| C | TYR94 |
| C | TRP114 |
| C | LEU152 |
| C | ASP153 |
| C | ALA154 |
| C | SER200 |
| C | LEU201 |
| C | ALA202 |
| C | LEU250 |
| C | THR251 |
| C | LYS270 |
| C | ALA297 |
| C | GLY298 |
| C | PRO299 |
| C | LEU300 |
| C | SER302 |
| C | ALA304 |
| C | TCL400 |
| C | HOH408 |
| site_id | AC6 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE TCL C 400 |
| Chain | Residue |
| C | GLY204 |
| C | TYR252 |
| C | TYR262 |
| C | ALA304 |
| C | ALA305 |
| C | NAD450 |
| site_id | AC7 |
| Number of Residues | 27 |
| Details | BINDING SITE FOR RESIDUE NAD B 550 |
| Chain | Residue |
| B | HOH35 |
| B | VAL88 |
| B | GLY89 |
| B | GLY93 |
| B | TYR94 |
| B | TRP114 |
| B | LEU152 |
| B | ASP153 |
| B | ALA154 |
| B | SER200 |
| B | LEU201 |
| B | ALA202 |
| B | ASN203 |
| B | LEU250 |
| B | THR251 |
| B | LYS270 |
| B | ALA297 |
| B | GLY298 |
| B | PRO299 |
| B | LEU300 |
| B | SER302 |
| B | ALA304 |
| B | HOH403 |
| B | HOH411 |
| B | HOH416 |
| B | HOH417 |
| B | TCL500 |
| site_id | AC8 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE TCL B 500 |
| Chain | Residue |
| B | ALA202 |
| B | GLY204 |
| B | TYR252 |
| B | TYR262 |
| B | ALA304 |
| B | ALA305 |
| B | NAD550 |
