Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0016491 | molecular_function | oxidoreductase activity |
| A | 0042208 | biological_process | propylene catabolic process |
| A | 0050628 | molecular_function | 2-oxopropyl-CoM reductase (carboxylating) activity |
| B | 0016491 | molecular_function | oxidoreductase activity |
| B | 0042208 | biological_process | propylene catabolic process |
| B | 0050628 | molecular_function | 2-oxopropyl-CoM reductase (carboxylating) activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 25 |
| Details | BINDING SITE FOR RESIDUE NAP A 1526 |
| Chain | Residue |
| A | HIS90 |
| A | LYS250 |
| A | GLY311 |
| A | LEU312 |
| A | GLY313 |
| A | MET359 |
| A | GLU360 |
| A | HOH567 |
| A | HOH634 |
| A | HOH667 |
| A | HOH672 |
| A | LEU189 |
| A | HOH742 |
| A | HOH951 |
| A | HOH952 |
| A | HOH954 |
| A | HOH960 |
| A | FAD1013 |
| A | GLY222 |
| A | SER223 |
| A | LYS224 |
| A | THR225 |
| A | GLU228 |
| A | ARG245 |
| A | THR246 |
| site_id | AC2 |
| Number of Residues | 37 |
| Details | BINDING SITE FOR RESIDUE FAD A 1013 |
| Chain | Residue |
| A | GLY50 |
| A | GLY52 |
| A | ALA53 |
| A | ALA54 |
| A | ASP73 |
| A | ARG74 |
| A | TRP75 |
| A | GLY80 |
| A | SER81 |
| A | ALA86 |
| A | CYS87 |
| A | HIS90 |
| A | HIS91 |
| A | PRO157 |
| A | ALA158 |
| A | ALA181 |
| A | VAL182 |
| A | GLY183 |
| A | HIS202 |
| A | TYR229 |
| A | GLY352 |
| A | ASP353 |
| A | MET359 |
| A | GLU360 |
| A | MET361 |
| A | ALA364 |
| A | HOH532 |
| A | HOH544 |
| A | HOH558 |
| A | HOH563 |
| A | HOH595 |
| A | HOH679 |
| A | HOH871 |
| A | HOH907 |
| A | HOH961 |
| A | NAP1526 |
| B | PHE501 |
| site_id | AC3 |
| Number of Residues | 3 |
| Details | BINDING SITE FOR RESIDUE ACN B 1040 |
| Chain | Residue |
| A | LEU431 |
| B | BCT524 |
| B | COM525 |
| site_id | AC4 |
| Number of Residues | 13 |
| Details | BINDING SITE FOR RESIDUE KPC A 526 |
| Chain | Residue |
| A | ALA53 |
| A | ARG56 |
| A | PHE57 |
| A | GLY79 |
| A | CYS82 |
| A | PRO83 |
| A | MET140 |
| A | MET361 |
| A | ARG365 |
| A | BCT524 |
| A | HOH599 |
| A | CO21090 |
| B | LEU431 |
| site_id | AC5 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG A 527 |
| Chain | Residue |
| A | LEU427 |
| A | VAL429 |
| A | LEU431 |
| A | ALA447 |
| A | SER450 |
| A | HOH686 |
| site_id | AC6 |
| Number of Residues | 8 |
| Details | BINDING SITE FOR RESIDUE BCT B 524 |
| Chain | Residue |
| A | LEU431 |
| A | PHE501 |
| A | HIS506 |
| A | GLN509 |
| B | ARG365 |
| B | HOH599 |
| B | HOH819 |
| B | ACN1040 |
| site_id | AC7 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE BCT A 524 |
| Chain | Residue |
| B | HIS506 |
| B | GLN509 |
| A | ARG365 |
| A | KPC526 |
| A | HOH599 |
| A | HOH697 |
| A | HOH735 |
| B | LEU431 |
| B | PHE501 |
| site_id | AC8 |
| Number of Residues | 29 |
| Details | BINDING SITE FOR RESIDUE NAP B 1526 |
| Chain | Residue |
| B | HIS90 |
| B | GLY222 |
| B | SER223 |
| B | LYS224 |
| B | THR225 |
| B | GLU228 |
| B | ARG245 |
| B | THR246 |
| B | LYS250 |
| B | GLY311 |
| B | LEU312 |
| B | GLY313 |
| B | GLU314 |
| B | MET359 |
| B | GLU360 |
| B | PHE390 |
| B | HOH556 |
| B | HOH615 |
| B | HOH655 |
| B | HOH662 |
| B | HOH775 |
| B | HOH840 |
| B | HOH903 |
| B | HOH926 |
| B | HOH981 |
| B | HOH999 |
| B | HOH1003 |
| B | HOH1006 |
| B | FAD1014 |
| site_id | AC9 |
| Number of Residues | 39 |
| Details | BINDING SITE FOR RESIDUE FAD B 1014 |
| Chain | Residue |
| A | PHE501 |
| A | HOH566 |
| B | GLY50 |
| B | GLY52 |
| B | ALA53 |
| B | ALA54 |
| B | VAL72 |
| B | ASP73 |
| B | ARG74 |
| B | TRP75 |
| B | GLY80 |
| B | SER81 |
| B | ALA86 |
| B | CYS87 |
| B | HIS90 |
| B | HIS91 |
| B | PRO157 |
| B | ALA158 |
| B | ALA181 |
| B | VAL182 |
| B | GLY183 |
| B | HIS202 |
| B | TYR229 |
| B | GLY352 |
| B | ASP353 |
| B | MET359 |
| B | GLU360 |
| B | MET361 |
| B | ALA364 |
| B | PHE390 |
| B | HOH545 |
| B | HOH598 |
| B | HOH603 |
| B | HOH607 |
| B | HOH665 |
| B | HOH721 |
| B | HOH936 |
| B | HOH969 |
| B | NAP1526 |
| site_id | BC1 |
| Number of Residues | 9 |
| Details | BINDING SITE FOR RESIDUE COM B 525 |
| Chain | Residue |
| B | ARG56 |
| B | PHE57 |
| B | GLY79 |
| B | CYS82 |
| B | PRO83 |
| B | MET140 |
| B | MET361 |
| B | ARG365 |
| B | ACN1040 |
| site_id | BC2 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE CO2 A 1090 |
| Chain | Residue |
| A | PRO136 |
| A | KPC526 |
| A | HOH735 |
| B | ALA430 |
| B | LEU431 |
| site_id | BC3 |
| Number of Residues | 6 |
| Details | BINDING SITE FOR RESIDUE MG B 527 |
| Chain | Residue |
| B | LEU427 |
| B | VAL429 |
| B | LEU431 |
| B | ALA447 |
| B | SER450 |
| B | HOH574 |
Functional Information from SwissProt/UniProt
| Chain | Residue | Details |
| A | ALA53 | |
| B | ASP353 | |
| B | MET361 | |
| B | PHE501 | |
| A | SER81 | |
| A | ALA158 | |
| A | ASP353 | |
| A | MET361 | |
| A | PHE501 | |
| B | ALA53 | |
| B | SER81 | |
| B | ALA158 | |
| Chain | Residue | Details |
| A | ARG56 | |
| A | ARG365 | |
| B | ARG56 | |
| B | ARG365 | |
| Chain | Residue | Details |
| A | CYS82 | |
| B | CYS82 | |
| Chain | Residue | Details |
| A | GLY222 | |
| A | ARG245 | |
| A | GLU360 | |
| B | GLY222 | |
| B | ARG245 | |
| B | GLU360 | |
Catalytic Information from CSA
| site_id | MCSA1 |
| Number of Residues | 5 |
| Details | M-CSA 378 |
| Chain | Residue | Details |
| A | LEU78 | electrostatic stabiliser, modifies pKa |
| A | CYS82 | covalent catalysis |
| A | CYS87 | covalent catalysis |
| A | HIS137 | modifies pKa |
| A | PHE501 | electrostatic stabiliser |
| site_id | MCSA2 |
| Number of Residues | 5 |
| Details | M-CSA 378 |
| Chain | Residue | Details |
| B | LEU78 | electrostatic stabiliser, modifies pKa |
| B | CYS82 | covalent catalysis |
| B | CYS87 | covalent catalysis |
| B | HIS137 | modifies pKa |
| B | PHE501 | electrostatic stabiliser |
