1NDA
THE STRUCTURE OF TRYPANOSOMA CRUZI TRYPANOTHIONE REDUCTASE IN THE OXIDIZED AND NADPH REDUCED STATE
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0004362 | molecular_function | glutathione-disulfide reductase (NADPH) activity |
| A | 0005737 | cellular_component | cytoplasm |
| A | 0005739 | cellular_component | mitochondrion |
| A | 0005829 | cellular_component | cytosol |
| A | 0006749 | biological_process | glutathione metabolic process |
| A | 0015036 | molecular_function | disulfide oxidoreductase activity |
| A | 0015042 | molecular_function | trypanothione-disulfide reductase (NADPH) activity |
| A | 0016491 | molecular_function | oxidoreductase activity |
| A | 0016668 | molecular_function | oxidoreductase activity, acting on a sulfur group of donors, NAD(P) as acceptor |
| A | 0034599 | biological_process | cellular response to oxidative stress |
| A | 0045454 | biological_process | cell redox homeostasis |
| A | 0050660 | molecular_function | flavin adenine dinucleotide binding |
| A | 0098869 | biological_process | cellular oxidant detoxification |
| B | 0004362 | molecular_function | glutathione-disulfide reductase (NADPH) activity |
| B | 0005737 | cellular_component | cytoplasm |
| B | 0005739 | cellular_component | mitochondrion |
| B | 0005829 | cellular_component | cytosol |
| B | 0006749 | biological_process | glutathione metabolic process |
| B | 0015036 | molecular_function | disulfide oxidoreductase activity |
| B | 0015042 | molecular_function | trypanothione-disulfide reductase (NADPH) activity |
| B | 0016491 | molecular_function | oxidoreductase activity |
| B | 0016668 | molecular_function | oxidoreductase activity, acting on a sulfur group of donors, NAD(P) as acceptor |
| B | 0034599 | biological_process | cellular response to oxidative stress |
| B | 0045454 | biological_process | cell redox homeostasis |
| B | 0050660 | molecular_function | flavin adenine dinucleotide binding |
| B | 0098869 | biological_process | cellular oxidant detoxification |
| C | 0004362 | molecular_function | glutathione-disulfide reductase (NADPH) activity |
| C | 0005737 | cellular_component | cytoplasm |
| C | 0005739 | cellular_component | mitochondrion |
| C | 0005829 | cellular_component | cytosol |
| C | 0006749 | biological_process | glutathione metabolic process |
| C | 0015036 | molecular_function | disulfide oxidoreductase activity |
| C | 0015042 | molecular_function | trypanothione-disulfide reductase (NADPH) activity |
| C | 0016491 | molecular_function | oxidoreductase activity |
| C | 0016668 | molecular_function | oxidoreductase activity, acting on a sulfur group of donors, NAD(P) as acceptor |
| C | 0034599 | biological_process | cellular response to oxidative stress |
| C | 0045454 | biological_process | cell redox homeostasis |
| C | 0050660 | molecular_function | flavin adenine dinucleotide binding |
| C | 0098869 | biological_process | cellular oxidant detoxification |
| D | 0004362 | molecular_function | glutathione-disulfide reductase (NADPH) activity |
| D | 0005737 | cellular_component | cytoplasm |
| D | 0005739 | cellular_component | mitochondrion |
| D | 0005829 | cellular_component | cytosol |
| D | 0006749 | biological_process | glutathione metabolic process |
| D | 0015036 | molecular_function | disulfide oxidoreductase activity |
| D | 0015042 | molecular_function | trypanothione-disulfide reductase (NADPH) activity |
| D | 0016491 | molecular_function | oxidoreductase activity |
| D | 0016668 | molecular_function | oxidoreductase activity, acting on a sulfur group of donors, NAD(P) as acceptor |
| D | 0034599 | biological_process | cellular response to oxidative stress |
| D | 0045454 | biological_process | cell redox homeostasis |
| D | 0050660 | molecular_function | flavin adenine dinucleotide binding |
| D | 0098869 | biological_process | cellular oxidant detoxification |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 30 |
| Details | BINDING SITE FOR RESIDUE FAD A 500 |
| Chain | Residue |
| A | GLY11 |
| A | THR51 |
| A | CYS52 |
| A | VAL55 |
| A | CYS57 |
| A | LYS60 |
| A | TRP126 |
| A | GLY127 |
| A | ALA159 |
| A | SER160 |
| A | GLY161 |
| A | GLY13 |
| A | PHE198 |
| A | ARG287 |
| A | ARG290 |
| A | LEU294 |
| A | GLY325 |
| A | ASP326 |
| A | MET332 |
| A | LEU333 |
| A | THR334 |
| A | PRO335 |
| A | SER14 |
| B | HIS460 |
| A | GLY15 |
| A | ILE34 |
| A | ASP35 |
| A | SER46 |
| A | ALA47 |
| A | GLY50 |
| site_id | AC2 |
| Number of Residues | 30 |
| Details | BINDING SITE FOR RESIDUE FAD B 500 |
| Chain | Residue |
| A | HIS460 |
| B | GLY11 |
| B | GLY13 |
| B | SER14 |
| B | GLY15 |
| B | ILE34 |
| B | ASP35 |
| B | SER46 |
| B | ALA47 |
| B | GLY50 |
| B | THR51 |
| B | CYS52 |
| B | VAL55 |
| B | CYS57 |
| B | LYS60 |
| B | TRP126 |
| B | GLY127 |
| B | ALA159 |
| B | SER160 |
| B | GLY161 |
| B | PHE198 |
| B | ARG287 |
| B | ARG290 |
| B | LEU294 |
| B | GLY325 |
| B | ASP326 |
| B | MET332 |
| B | LEU333 |
| B | THR334 |
| B | PRO335 |
| site_id | AC3 |
| Number of Residues | 30 |
| Details | BINDING SITE FOR RESIDUE FAD C 500 |
| Chain | Residue |
| C | GLY11 |
| C | GLY13 |
| C | SER14 |
| C | GLY15 |
| C | ILE34 |
| C | ASP35 |
| C | SER46 |
| C | ALA47 |
| C | GLY50 |
| C | THR51 |
| C | CYS52 |
| C | VAL55 |
| C | CYS57 |
| C | LYS60 |
| C | TRP126 |
| C | GLY127 |
| C | ALA159 |
| C | SER160 |
| C | GLY161 |
| C | PHE198 |
| C | ARG287 |
| C | ARG290 |
| C | LEU294 |
| C | GLY325 |
| C | ASP326 |
| C | MET332 |
| C | LEU333 |
| C | THR334 |
| C | PRO335 |
| D | HIS460 |
| site_id | AC4 |
| Number of Residues | 30 |
| Details | BINDING SITE FOR RESIDUE FAD D 500 |
| Chain | Residue |
| D | GLY50 |
| D | THR51 |
| D | CYS52 |
| D | VAL55 |
| D | CYS57 |
| D | LYS60 |
| D | TRP126 |
| D | GLY127 |
| D | ALA159 |
| D | SER160 |
| D | GLY161 |
| D | PHE198 |
| D | ARG287 |
| D | ARG290 |
| D | LEU294 |
| D | GLY325 |
| D | ASP326 |
| D | MET332 |
| D | LEU333 |
| D | THR334 |
| D | PRO335 |
| C | HIS460 |
| D | GLY11 |
| D | GLY13 |
| D | SER14 |
| D | GLY15 |
| D | ILE34 |
| D | ASP35 |
| D | SER46 |
| D | ALA47 |
Functional Information from PROSITE/UniProt
| site_id | PS00076 |
| Number of Residues | 11 |
| Details | PYRIDINE_REDOX_1 Pyridine nucleotide-disulphide oxidoreductases class-I active site. GGtCVnvGCVP |
| Chain | Residue | Details |
| A | GLY49-PRO59 |
Functional Information from SwissProt/UniProt
| site_id | SWS_FT_FI1 |
| Number of Residues | 4 |
| Details | Active site: {"description":"Proton acceptor","evidences":[{"evidenceCode":"ECO:0000250"}]} |
| Chain | Residue | Details |
| site_id | SWS_FT_FI2 |
| Number of Residues | 64 |
| Details | Binding site: {} |
| Chain | Residue | Details |
Catalytic Information from CSA
| site_id | CSA1 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1get |
| Chain | Residue | Details |
| C | CYS52 | |
| C | CYS57 |
| site_id | CSA2 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1get |
| Chain | Residue | Details |
| D | CYS52 | |
| D | CYS57 |
| site_id | CSA3 |
| Number of Residues | 7 |
| Details | Annotated By Reference To The Literature 1get |
| Chain | Residue | Details |
| A | GLU465 | |
| A | HIS460 | |
| B | PHE198 | |
| B | LYS60 | |
| B | CYS52 | |
| B | CYS57 | |
| B | GLU202 |
| site_id | CSA4 |
| Number of Residues | 7 |
| Details | Annotated By Reference To The Literature 1get |
| Chain | Residue | Details |
| A | LYS60 | |
| A | PHE198 | |
| A | CYS52 | |
| A | CYS57 | |
| A | GLU202 | |
| B | GLU465 | |
| B | HIS460 |
| site_id | CSA5 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1get |
| Chain | Residue | Details |
| C | GLU465 | |
| C | HIS460 |
| site_id | CSA6 |
| Number of Residues | 2 |
| Details | Annotated By Reference To The Literature 1get |
| Chain | Residue | Details |
| D | GLU465 | |
| D | HIS460 |
