2XVJ
Crystal structure of the mutant bacterial flavin containing monooxygenase in complex with indole
Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0000166 | molecular_function | nucleotide binding |
A | 0004497 | molecular_function | monooxygenase activity |
A | 0004499 | molecular_function | N,N-dimethylaniline monooxygenase activity |
A | 0042802 | molecular_function | identical protein binding |
A | 0050660 | molecular_function | flavin adenine dinucleotide binding |
A | 0050661 | molecular_function | NADP binding |
B | 0000166 | molecular_function | nucleotide binding |
B | 0004497 | molecular_function | monooxygenase activity |
B | 0004499 | molecular_function | N,N-dimethylaniline monooxygenase activity |
B | 0042802 | molecular_function | identical protein binding |
B | 0050660 | molecular_function | flavin adenine dinucleotide binding |
B | 0050661 | molecular_function | NADP binding |
C | 0000166 | molecular_function | nucleotide binding |
C | 0004497 | molecular_function | monooxygenase activity |
C | 0004499 | molecular_function | N,N-dimethylaniline monooxygenase activity |
C | 0042802 | molecular_function | identical protein binding |
C | 0050660 | molecular_function | flavin adenine dinucleotide binding |
C | 0050661 | molecular_function | NADP binding |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 25 |
Details | BINDING SITE FOR RESIDUE FAD A 1448 |
Chain | Residue |
A | GLY9 |
A | TRP47 |
A | HIS63 |
A | MET66 |
A | SER72 |
A | ASN73 |
A | LEU79 |
A | VAL126 |
A | CYS161 |
A | THR162 |
A | GLY163 |
A | GLY11 |
A | PHE165 |
A | PHE280 |
A | GLN318 |
A | SER321 |
A | IND1450 |
A | HOH2008 |
A | PRO12 |
A | SER13 |
A | GLU38 |
A | LYS39 |
A | GLN40 |
A | GLY45 |
A | GLN46 |
site_id | AC2 |
Number of Residues | 30 |
Details | BINDING SITE FOR RESIDUE FAD B 1447 |
Chain | Residue |
B | GLY9 |
B | GLY11 |
B | PRO12 |
B | SER13 |
B | GLU38 |
B | LYS39 |
B | GLN40 |
B | GLY45 |
B | GLN46 |
B | TRP47 |
B | HIS63 |
B | SER65 |
B | MET66 |
B | SER72 |
B | ASN73 |
B | LEU79 |
B | THR124 |
B | ALA125 |
B | VAL126 |
B | CYS161 |
B | THR162 |
B | GLY163 |
B | PHE165 |
B | GLN318 |
B | SER321 |
B | PHE325 |
B | IND1449 |
B | HOH2009 |
B | HOH2030 |
B | HOH2054 |
site_id | AC3 |
Number of Residues | 29 |
Details | BINDING SITE FOR RESIDUE FAD C 1448 |
Chain | Residue |
C | GLY9 |
C | GLY11 |
C | PRO12 |
C | SER13 |
C | GLU38 |
C | LYS39 |
C | GLN40 |
C | GLY45 |
C | GLN46 |
C | TRP47 |
C | HIS63 |
C | SER65 |
C | MET66 |
C | ASN73 |
C | LEU79 |
C | THR124 |
C | ALA125 |
C | VAL126 |
C | CYS161 |
C | THR162 |
C | GLY163 |
C | PHE165 |
C | GLN318 |
C | SER321 |
C | PHE325 |
C | IND1450 |
C | HOH2019 |
C | HOH2043 |
C | HOH2044 |
site_id | AC4 |
Number of Residues | 8 |
Details | BINDING SITE FOR RESIDUE NO3 A 1449 |
Chain | Residue |
A | HIS185 |
A | ALA186 |
A | SER206 |
A | SER208 |
A | CYS271 |
A | THR272 |
A | GLY273 |
A | TYR274 |
site_id | AC5 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE NO3 B 1448 |
Chain | Residue |
B | ALA186 |
B | SER206 |
B | CYS271 |
B | THR272 |
B | GLY273 |
B | TYR274 |
site_id | AC6 |
Number of Residues | 7 |
Details | BINDING SITE FOR RESIDUE NO3 C 1449 |
Chain | Residue |
C | SER206 |
C | SER208 |
C | CYS271 |
C | THR272 |
C | GLY273 |
C | HOH2030 |
C | HIS185 |
site_id | AC7 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE IND A 1450 |
Chain | Residue |
A | ASN73 |
A | PHE165 |
A | SER208 |
A | FAD1448 |
A | OXY1451 |
site_id | AC8 |
Number of Residues | 5 |
Details | BINDING SITE FOR RESIDUE IND B 1449 |
Chain | Residue |
B | ASN73 |
B | PHE165 |
B | SER208 |
B | FAD1447 |
B | OXY1451 |
site_id | AC9 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE IND C 1450 |
Chain | Residue |
C | PHE165 |
C | SER208 |
C | FAD1448 |
C | OXY1451 |
site_id | BC1 |
Number of Residues | 6 |
Details | BINDING SITE FOR RESIDUE MES B 1450 |
Chain | Residue |
B | ARG19 |
B | GLN22 |
B | GLU26 |
B | LYS113 |
B | ALA114 |
C | ASN290 |
site_id | BC2 |
Number of Residues | 3 |
Details | BINDING SITE FOR RESIDUE OXY A 1451 |
Chain | Residue |
A | ASN73 |
A | TRP319 |
A | IND1450 |
site_id | BC3 |
Number of Residues | 4 |
Details | BINDING SITE FOR RESIDUE OXY B 1451 |
Chain | Residue |
B | ASN73 |
B | GLN318 |
B | TRP319 |
B | IND1449 |
site_id | BC4 |
Number of Residues | 2 |
Details | BINDING SITE FOR RESIDUE OXY C 1451 |
Chain | Residue |
C | TRP319 |
C | IND1450 |