3EC7
Crystal Structure of Putative Dehydrogenase from Salmonella typhimurium LT2
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0000166 | molecular_function | nucleotide binding |
| A | 0016491 | molecular_function | oxidoreductase activity |
| A | 0019310 | biological_process | inositol catabolic process |
| A | 0050112 | molecular_function | inositol 2-dehydrogenase (NAD+) activity |
| B | 0000166 | molecular_function | nucleotide binding |
| B | 0016491 | molecular_function | oxidoreductase activity |
| B | 0019310 | biological_process | inositol catabolic process |
| B | 0050112 | molecular_function | inositol 2-dehydrogenase (NAD+) activity |
| C | 0000166 | molecular_function | nucleotide binding |
| C | 0016491 | molecular_function | oxidoreductase activity |
| C | 0019310 | biological_process | inositol catabolic process |
| C | 0050112 | molecular_function | inositol 2-dehydrogenase (NAD+) activity |
| D | 0000166 | molecular_function | nucleotide binding |
| D | 0016491 | molecular_function | oxidoreductase activity |
| D | 0019310 | biological_process | inositol catabolic process |
| D | 0050112 | molecular_function | inositol 2-dehydrogenase (NAD+) activity |
| E | 0000166 | molecular_function | nucleotide binding |
| E | 0016491 | molecular_function | oxidoreductase activity |
| E | 0019310 | biological_process | inositol catabolic process |
| E | 0050112 | molecular_function | inositol 2-dehydrogenase (NAD+) activity |
| F | 0000166 | molecular_function | nucleotide binding |
| F | 0016491 | molecular_function | oxidoreductase activity |
| F | 0019310 | biological_process | inositol catabolic process |
| F | 0050112 | molecular_function | inositol 2-dehydrogenase (NAD+) activity |
| G | 0000166 | molecular_function | nucleotide binding |
| G | 0016491 | molecular_function | oxidoreductase activity |
| G | 0019310 | biological_process | inositol catabolic process |
| G | 0050112 | molecular_function | inositol 2-dehydrogenase (NAD+) activity |
| H | 0000166 | molecular_function | nucleotide binding |
| H | 0016491 | molecular_function | oxidoreductase activity |
| H | 0019310 | biological_process | inositol catabolic process |
| H | 0050112 | molecular_function | inositol 2-dehydrogenase (NAD+) activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 25 |
| Details | BINDING SITE FOR RESIDUE NAD A 400 |
| Chain | Residue |
| A | VAL8 |
| A | ALA74 |
| A | SER75 |
| A | ASN76 |
| A | HIS79 |
| A | GLU96 |
| A | LYS97 |
| A | GLY124 |
| A | MSE126 |
| A | TRP271 |
| A | TYR279 |
| A | GLY9 |
| A | HOH421 |
| A | HOH566 |
| A | HOH587 |
| A | HOH652 |
| A | HOH693 |
| A | HOH694 |
| A | GLY11 |
| A | MSE12 |
| A | ILE13 |
| A | ASP35 |
| A | ILE36 |
| A | ARG40 |
| A | THR73 |
| site_id | AC2 |
| Number of Residues | 11 |
| Details | BINDING SITE FOR RESIDUE EPE A 401 |
| Chain | Residue |
| A | HIS155 |
| A | THR160 |
| A | VAL161 |
| A | GLU172 |
| A | THR173 |
| A | HIS176 |
| A | TYR234 |
| A | TRP271 |
| A | HOH451 |
| A | HOH571 |
| A | HOH696 |
| site_id | AC3 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE ACY A 402 |
| Chain | Residue |
| A | ASP312 |
| A | VAL315 |
| A | LYS316 |
| A | GLU319 |
| A | HOH609 |
| site_id | AC4 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE ACY A 403 |
| Chain | Residue |
| A | GLN231 |
| A | VAL269 |
| A | HOH675 |
| C | ALA260 |
| site_id | AC5 |
| Number of Residues | 24 |
| Details | BINDING SITE FOR RESIDUE NAD B 400 |
| Chain | Residue |
| B | GLY9 |
| B | GLY11 |
| B | MSE12 |
| B | ILE13 |
| B | CYS34 |
| B | ASP35 |
| B | ILE36 |
| B | VAL37 |
| B | ARG40 |
| B | THR73 |
| B | ALA74 |
| B | SER75 |
| B | ASN76 |
| B | HIS79 |
| B | GLU96 |
| B | LYS97 |
| B | PRO98 |
| B | GLY124 |
| B | MSE126 |
| B | TYR279 |
| B | HOH485 |
| B | HOH516 |
| B | HOH646 |
| B | HOH657 |
| site_id | AC6 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE EPE B 401 |
| Chain | Residue |
| B | HIS155 |
| B | ASN157 |
| B | THR160 |
| B | VAL161 |
| B | GLU172 |
| B | THR173 |
| B | HIS176 |
| B | TYR234 |
| B | TRP271 |
| site_id | AC7 |
| Number of Residues | 24 |
| Details | BINDING SITE FOR RESIDUE NAD C 400 |
| Chain | Residue |
| C | HOH602 |
| C | HOH614 |
| C | HOH618 |
| C | GLY9 |
| C | GLY11 |
| C | MSE12 |
| C | ILE13 |
| C | ASP35 |
| C | ILE36 |
| C | VAL37 |
| C | ARG40 |
| C | THR73 |
| C | ALA74 |
| C | SER75 |
| C | ASN76 |
| C | ALA78 |
| C | HIS79 |
| C | GLU96 |
| C | LYS97 |
| C | PRO98 |
| C | GLY124 |
| C | MSE126 |
| C | TYR279 |
| C | HOH471 |
| site_id | AC8 |
| Number of Residues | 12 |
| Details | BINDING SITE FOR RESIDUE EPE C 401 |
| Chain | Residue |
| C | HIS155 |
| C | ASN157 |
| C | THR160 |
| C | VAL161 |
| C | TYR164 |
| C | GLU172 |
| C | THR173 |
| C | HIS176 |
| C | TYR234 |
| C | TRP271 |
| C | HOH449 |
| C | HOH531 |
| site_id | AC9 |
| Number of Residues | 26 |
| Details | BINDING SITE FOR RESIDUE NAD D 400 |
| Chain | Residue |
| D | VAL8 |
| D | GLY9 |
| D | GLY11 |
| D | MSE12 |
| D | ILE13 |
| D | ASP35 |
| D | ILE36 |
| D | VAL37 |
| D | ARG40 |
| D | THR73 |
| D | ALA74 |
| D | SER75 |
| D | ASN76 |
| D | HIS79 |
| D | GLU96 |
| D | LYS97 |
| D | PRO98 |
| D | GLY124 |
| D | MSE126 |
| D | TRP271 |
| D | TYR279 |
| D | HOH435 |
| D | HOH469 |
| D | HOH617 |
| D | HOH621 |
| D | HOH644 |
| site_id | BC1 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE EPE D 401 |
| Chain | Residue |
| D | HIS155 |
| D | THR160 |
| D | VAL161 |
| D | GLU172 |
| D | THR173 |
| D | HIS176 |
| D | TYR234 |
| D | TRP271 |
| D | HOH543 |
| D | HOH544 |
| site_id | BC2 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE EDO D 402 |
| Chain | Residue |
| A | GLN135 |
| B | LYS262 |
| D | ALA255 |
| D | VAL257 |
| D | SER264 |
| D | THR265 |
| D | ASP266 |
| D | HOH647 |
| site_id | BC3 |
| Number of Residues | 24 |
| Details | BINDING SITE FOR RESIDUE NAD E 400 |
| Chain | Residue |
| E | VAL8 |
| E | GLY9 |
| E | GLY11 |
| E | MSE12 |
| E | ILE13 |
| E | ASP35 |
| E | ILE36 |
| E | ARG40 |
| E | THR73 |
| E | ALA74 |
| E | SER75 |
| E | ASN76 |
| E | HIS79 |
| E | GLU96 |
| E | LYS97 |
| E | PRO98 |
| E | GLY124 |
| E | MSE126 |
| E | TYR279 |
| E | HOH533 |
| E | HOH638 |
| E | HOH705 |
| E | HOH727 |
| E | HOH753 |
| site_id | BC4 |
| Number of Residues | 12 |
| Details | BINDING SITE FOR RESIDUE EPE E 401 |
| Chain | Residue |
| E | HIS155 |
| E | THR160 |
| E | VAL161 |
| E | TYR164 |
| E | GLU172 |
| E | THR173 |
| E | HIS176 |
| E | TYR234 |
| E | TRP271 |
| E | HOH648 |
| E | HOH683 |
| E | HOH753 |
| site_id | BC5 |
| Number of Residues | 7 |
| Details | BINDING SITE FOR RESIDUE EDO E 402 |
| Chain | Residue |
| E | ALA255 |
| E | VAL257 |
| E | SER264 |
| E | THR265 |
| E | ASP266 |
| E | HOH793 |
| G | LYS262 |
| site_id | BC6 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE EDO E 403 |
| Chain | Residue |
| E | TYR171 |
| E | ASP312 |
| E | LYS316 |
| E | GLU319 |
| E | HOH698 |
| site_id | BC7 |
| Number of Residues | 26 |
| Details | BINDING SITE FOR RESIDUE NAD F 400 |
| Chain | Residue |
| F | GLY9 |
| F | GLY11 |
| F | MSE12 |
| F | ILE13 |
| F | CYS34 |
| F | ASP35 |
| F | ILE36 |
| F | VAL37 |
| F | ARG40 |
| F | TYR58 |
| F | THR73 |
| F | ALA74 |
| F | SER75 |
| F | ASN76 |
| F | ALA78 |
| F | HIS79 |
| F | GLU96 |
| F | LYS97 |
| F | PRO98 |
| F | GLY124 |
| F | MSE126 |
| F | TYR279 |
| F | HOH444 |
| F | HOH490 |
| F | HOH522 |
| F | HOH568 |
| site_id | BC8 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE EPE F 401 |
| Chain | Residue |
| F | HIS155 |
| F | THR160 |
| F | VAL161 |
| F | GLU172 |
| F | THR173 |
| F | HIS176 |
| F | TYR234 |
| F | TRP271 |
| F | HOH568 |
| F | HOH626 |
| site_id | BC9 |
| Number of Residues | 25 |
| Details | BINDING SITE FOR RESIDUE NAD G 400 |
| Chain | Residue |
| G | GLY9 |
| G | GLY11 |
| G | MSE12 |
| G | ILE13 |
| G | ASP35 |
| G | ILE36 |
| G | VAL37 |
| G | ARG40 |
| G | THR73 |
| G | ALA74 |
| G | SER75 |
| G | ASN76 |
| G | HIS79 |
| G | GLU96 |
| G | LYS97 |
| G | PRO98 |
| G | GLY124 |
| G | MSE126 |
| G | TYR279 |
| G | HOH635 |
| G | HOH726 |
| G | HOH753 |
| G | HOH773 |
| G | HOH790 |
| G | HOH799 |
| site_id | CC1 |
| Number of Residues | 14 |
| Details | BINDING SITE FOR RESIDUE EPE G 401 |
| Chain | Residue |
| G | HIS155 |
| G | THR160 |
| G | VAL161 |
| G | TYR164 |
| G | GLU172 |
| G | THR173 |
| G | HIS176 |
| G | TYR234 |
| G | TRP271 |
| G | HOH700 |
| G | HOH726 |
| G | HOH769 |
| G | HOH807 |
| G | HOH808 |
| site_id | CC2 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO G 402 |
| Chain | Residue |
| G | ASP130 |
| G | GLY132 |
| G | PRO250 |
| G | THR251 |
| G | ARG274 |
| G | HOH779 |
| site_id | CC3 |
| Number of Residues | 25 |
| Details | BINDING SITE FOR RESIDUE NAD H 400 |
| Chain | Residue |
| H | VAL8 |
| H | GLY9 |
| H | GLY11 |
| H | MSE12 |
| H | ILE13 |
| H | ASP35 |
| H | ILE36 |
| H | VAL37 |
| H | ARG40 |
| H | THR73 |
| H | ALA74 |
| H | SER75 |
| H | ASN76 |
| H | HIS79 |
| H | GLU96 |
| H | LYS97 |
| H | PRO98 |
| H | GLY124 |
| H | MSE126 |
| H | TYR279 |
| H | HOH411 |
| H | HOH422 |
| H | HOH494 |
| H | HOH587 |
| H | HOH667 |
| site_id | CC4 |
| Number of Residues | 10 |
| Details | BINDING SITE FOR RESIDUE EPE H 401 |
| Chain | Residue |
| H | HIS155 |
| H | THR160 |
| H | VAL161 |
| H | GLU172 |
| H | THR173 |
| H | HIS176 |
| H | TYR234 |
| H | TRP271 |
| H | HOH550 |
| H | HOH655 |
| site_id | CC5 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE EDO H 402 |
| Chain | Residue |
| F | LYS262 |
| H | ALA255 |
| H | VAL257 |
| H | SER264 |
| H | ASP266 |
| H | HOH640 |
