4P1B
CRYSTAL STRUCTURE OF THE TOLUENE 4-MONOOXYGENASE HYDROXYLASE-FERREDOXIN C7S E16C C84A C85A VARIANT ELECTRON-TRANSFER COMPLEX
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004497 | molecular_function | monooxygenase activity |
| A | 0009056 | biological_process | catabolic process |
| A | 0016491 | molecular_function | oxidoreductase activity |
| A | 0018638 | molecular_function | toluene 4-monooxygenase activity |
| A | 0042203 | biological_process | toluene catabolic process |
| A | 0046872 | molecular_function | metal ion binding |
| B | 0004497 | molecular_function | monooxygenase activity |
| B | 0009056 | biological_process | catabolic process |
| B | 0016491 | molecular_function | oxidoreductase activity |
| B | 0016709 | molecular_function | oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, NAD(P)H as one donor, and incorporation of one atom of oxygen |
| B | 0018638 | molecular_function | toluene 4-monooxygenase activity |
| B | 0042203 | biological_process | toluene catabolic process |
| C | 0004497 | molecular_function | monooxygenase activity |
| C | 0009056 | biological_process | catabolic process |
| C | 0018638 | molecular_function | toluene 4-monooxygenase activity |
| C | 0042203 | biological_process | toluene catabolic process |
| D | 0004497 | molecular_function | monooxygenase activity |
| D | 0009056 | biological_process | catabolic process |
| D | 0016491 | molecular_function | oxidoreductase activity |
| D | 0018638 | molecular_function | toluene 4-monooxygenase activity |
| D | 0042203 | biological_process | toluene catabolic process |
| D | 0046872 | molecular_function | metal ion binding |
| E | 0004497 | molecular_function | monooxygenase activity |
| E | 0009056 | biological_process | catabolic process |
| E | 0016491 | molecular_function | oxidoreductase activity |
| E | 0016709 | molecular_function | oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, NAD(P)H as one donor, and incorporation of one atom of oxygen |
| E | 0018638 | molecular_function | toluene 4-monooxygenase activity |
| E | 0042203 | biological_process | toluene catabolic process |
| F | 0004497 | molecular_function | monooxygenase activity |
| F | 0009056 | biological_process | catabolic process |
| F | 0018638 | molecular_function | toluene 4-monooxygenase activity |
| F | 0042203 | biological_process | toluene catabolic process |
| H | 0009056 | biological_process | catabolic process |
| H | 0042203 | biological_process | toluene catabolic process |
| H | 0046872 | molecular_function | metal ion binding |
| H | 0051537 | molecular_function | 2 iron, 2 sulfur cluster binding |
| I | 0009056 | biological_process | catabolic process |
| I | 0042203 | biological_process | toluene catabolic process |
| I | 0046872 | molecular_function | metal ion binding |
| I | 0051537 | molecular_function | 2 iron, 2 sulfur cluster binding |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 7 |
| Details | binding site for residue FE A 501 |
| Chain | Residue |
| A | GLU104 |
| A | GLU134 |
| A | HIS137 |
| A | GLU231 |
| A | FE502 |
| A | ACT504 |
| A | HOH967 |
| site_id | AC2 |
| Number of Residues | 7 |
| Details | binding site for residue FE A 502 |
| Chain | Residue |
| A | GLU231 |
| A | HIS234 |
| A | FE501 |
| A | ACT504 |
| A | HOH967 |
| A | GLU134 |
| A | GLU197 |
| site_id | AC3 |
| Number of Residues | 5 |
| Details | binding site for residue ACT A 503 |
| Chain | Residue |
| A | ARG339 |
| A | LYS481 |
| A | ASP482 |
| A | PHE486 |
| A | HOH818 |
| site_id | AC4 |
| Number of Residues | 9 |
| Details | binding site for residue ACT A 504 |
| Chain | Residue |
| A | GLU104 |
| A | HIS137 |
| A | GLU197 |
| A | PHE205 |
| A | GLN228 |
| A | GLU231 |
| A | FE501 |
| A | FE502 |
| A | HOH967 |
| site_id | AC5 |
| Number of Residues | 5 |
| Details | binding site for residue ACT A 505 |
| Chain | Residue |
| A | TYR51 |
| A | THR53 |
| A | ARG233 |
| A | HOH724 |
| A | HOH801 |
| site_id | AC6 |
| Number of Residues | 5 |
| Details | binding site for residue NA A 506 |
| Chain | Residue |
| A | PRO461 |
| A | THR463 |
| A | GLU465 |
| A | HOH972 |
| A | HOH991 |
| site_id | AC7 |
| Number of Residues | 8 |
| Details | binding site for residue ACT B 401 |
| Chain | Residue |
| B | ARG59 |
| B | ASN60 |
| B | SER62 |
| B | LEU64 |
| B | LYS65 |
| B | TRP69 |
| B | TRP212 |
| B | HOH1008 |
| site_id | AC8 |
| Number of Residues | 6 |
| Details | binding site for residue FE D 501 |
| Chain | Residue |
| D | GLU104 |
| D | GLU134 |
| D | HIS137 |
| D | FE502 |
| D | ACT506 |
| D | HOH950 |
| site_id | AC9 |
| Number of Residues | 7 |
| Details | binding site for residue FE D 502 |
| Chain | Residue |
| D | GLU134 |
| D | GLU197 |
| D | GLU231 |
| D | HIS234 |
| D | FE501 |
| D | ACT506 |
| D | HOH950 |
| site_id | AD1 |
| Number of Residues | 2 |
| Details | binding site for residue PEG D 503 |
| Chain | Residue |
| D | TRP315 |
| D | GLU431 |
| site_id | AD2 |
| Number of Residues | 5 |
| Details | binding site for residue ACT D 504 |
| Chain | Residue |
| D | TYR51 |
| D | THR53 |
| D | ARG233 |
| D | HOH675 |
| D | HOH891 |
| site_id | AD3 |
| Number of Residues | 2 |
| Details | binding site for residue ACT D 505 |
| Chain | Residue |
| D | GLY207 |
| D | TRP297 |
| site_id | AD4 |
| Number of Residues | 10 |
| Details | binding site for residue ACT D 506 |
| Chain | Residue |
| D | GLU104 |
| D | HIS137 |
| D | GLU197 |
| D | PHE205 |
| D | GLU231 |
| D | FE501 |
| D | FE502 |
| D | HOH687 |
| D | HOH949 |
| D | HOH950 |
| site_id | AD5 |
| Number of Residues | 6 |
| Details | binding site for residue FES H 201 |
| Chain | Residue |
| H | CYS45 |
| H | HIS47 |
| H | GLN48 |
| H | CYS64 |
| H | HIS67 |
| H | TRP69 |
| site_id | AD6 |
| Number of Residues | 6 |
| Details | binding site for residue FES I 201 |
| Chain | Residue |
| I | CYS45 |
| I | HIS47 |
| I | GLN48 |
| I | CYS64 |
| I | HIS67 |
| I | TRP69 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 8 |
| Details | BINDING: BINDING => ECO:0000269|PubMed:15452777, ECO:0000269|PubMed:16627939, ECO:0000269|PubMed:17850744, ECO:0000269|PubMed:25248368, ECO:0007744|PDB:1SJG, ECO:0007744|PDB:1VM9, ECO:0007744|PDB:2Q3W, ECO:0007744|PDB:4P1B, ECO:0007744|PDB:4P1C |
| Chain | Residue | Details |
| H | CYS45 | |
| D | GLU197 | |
| D | GLU231 | |
| D | HIS234 | |
| H | HIS47 | |
| H | CYS64 | |
| H | HIS67 | |
| I | CYS45 | |
| I | HIS47 | |
| I | CYS64 | |
| I | HIS67 | |
| D | HIS137 |
