4F07
Structure of the Styrene Monooxygenase Flavin Reductase (SMOB) from Pseudomonas putida S12
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0000166 | molecular_function | nucleotide binding |
| A | 0004497 | molecular_function | monooxygenase activity |
| A | 0010181 | molecular_function | FMN binding |
| A | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| A | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| B | 0000166 | molecular_function | nucleotide binding |
| B | 0004497 | molecular_function | monooxygenase activity |
| B | 0010181 | molecular_function | FMN binding |
| B | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| B | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| C | 0000166 | molecular_function | nucleotide binding |
| C | 0004497 | molecular_function | monooxygenase activity |
| C | 0010181 | molecular_function | FMN binding |
| C | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| C | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| D | 0000166 | molecular_function | nucleotide binding |
| D | 0004497 | molecular_function | monooxygenase activity |
| D | 0010181 | molecular_function | FMN binding |
| D | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| D | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| E | 0000166 | molecular_function | nucleotide binding |
| E | 0004497 | molecular_function | monooxygenase activity |
| E | 0010181 | molecular_function | FMN binding |
| E | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| E | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| F | 0000166 | molecular_function | nucleotide binding |
| F | 0004497 | molecular_function | monooxygenase activity |
| F | 0010181 | molecular_function | FMN binding |
| F | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| F | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| G | 0000166 | molecular_function | nucleotide binding |
| G | 0004497 | molecular_function | monooxygenase activity |
| G | 0010181 | molecular_function | FMN binding |
| G | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| G | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| H | 0000166 | molecular_function | nucleotide binding |
| H | 0004497 | molecular_function | monooxygenase activity |
| H | 0010181 | molecular_function | FMN binding |
| H | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| H | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| I | 0000166 | molecular_function | nucleotide binding |
| I | 0004497 | molecular_function | monooxygenase activity |
| I | 0010181 | molecular_function | FMN binding |
| I | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| I | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| J | 0000166 | molecular_function | nucleotide binding |
| J | 0004497 | molecular_function | monooxygenase activity |
| J | 0010181 | molecular_function | FMN binding |
| J | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| J | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| K | 0000166 | molecular_function | nucleotide binding |
| K | 0004497 | molecular_function | monooxygenase activity |
| K | 0010181 | molecular_function | FMN binding |
| K | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| K | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
| L | 0000166 | molecular_function | nucleotide binding |
| L | 0004497 | molecular_function | monooxygenase activity |
| L | 0010181 | molecular_function | FMN binding |
| L | 0016646 | molecular_function | oxidoreductase activity, acting on the CH-NH group of donors, NAD or NADP as acceptor |
| L | 0042602 | molecular_function | riboflavin reductase (NADPH) activity |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 21 |
| Details | BINDING SITE FOR RESIDUE FAD A 201 |
| Chain | Residue |
| A | HIS40 |
| A | SER63 |
| A | ARG65 |
| A | MET66 |
| A | SER93 |
| A | ARG95 |
| A | NO3202 |
| A | NO3203 |
| A | HOH301 |
| E | SER49 |
| E | ILE50 |
| A | MET42 |
| E | LEU52 |
| F | VAL20 |
| A | THR43 |
| A | VAL44 |
| A | ASN45 |
| A | SER46 |
| A | SER60 |
| A | LEU61 |
| A | LYS62 |
| site_id | AC2 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 A 202 |
| Chain | Residue |
| A | ARG95 |
| A | FAD201 |
| F | LYS62 |
| F | FAD500 |
| site_id | AC3 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 A 203 |
| Chain | Residue |
| A | LYS62 |
| A | FAD201 |
| F | ARG95 |
| F | FAD500 |
| site_id | AC4 |
| Number of Residues | 26 |
| Details | BINDING SITE FOR RESIDUE FAD B 201 |
| Chain | Residue |
| B | ILE27 |
| B | HIS40 |
| B | MET42 |
| B | THR43 |
| B | VAL44 |
| B | ASN45 |
| B | SER46 |
| B | SER60 |
| B | LEU61 |
| B | LYS62 |
| B | SER63 |
| B | ARG65 |
| B | MET66 |
| B | SER93 |
| B | LYS94 |
| B | ARG95 |
| B | NO3202 |
| B | HOH308 |
| B | HOH324 |
| B | HOH358 |
| G | VAL20 |
| G | LYS62 |
| G | NO3202 |
| G | HOH315 |
| H | SER49 |
| H | LEU52 |
| site_id | AC5 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 B 202 |
| Chain | Residue |
| B | LYS62 |
| B | FAD201 |
| G | ARG95 |
| G | FAD201 |
| site_id | AC6 |
| Number of Residues | 24 |
| Details | BINDING SITE FOR RESIDUE FAD C 201 |
| Chain | Residue |
| C | HIS40 |
| C | MET42 |
| C | THR43 |
| C | VAL44 |
| C | ASN45 |
| C | SER46 |
| C | SER60 |
| C | LEU61 |
| C | LYS62 |
| C | SER63 |
| C | GLY64 |
| C | ARG65 |
| C | MET66 |
| C | SER93 |
| C | LYS94 |
| C | ARG95 |
| C | NO3202 |
| C | HOH309 |
| C | HOH337 |
| G | SER49 |
| G | LEU52 |
| H | VAL20 |
| H | ARG95 |
| H | NO3202 |
| site_id | AC7 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 C 202 |
| Chain | Residue |
| C | ARG95 |
| C | FAD201 |
| H | LYS62 |
| H | FAD201 |
| site_id | AC8 |
| Number of Residues | 25 |
| Details | BINDING SITE FOR RESIDUE FAD D 201 |
| Chain | Residue |
| D | ARG95 |
| D | NO3202 |
| D | HOH322 |
| D | HOH332 |
| D | HOH333 |
| E | ARG17 |
| E | VAL20 |
| E | LYS62 |
| E | NO3202 |
| E | HOH306 |
| F | SER49 |
| F | ILE50 |
| F | LEU52 |
| D | HIS40 |
| D | MET42 |
| D | THR43 |
| D | VAL44 |
| D | ASN45 |
| D | SER46 |
| D | SER60 |
| D | LEU61 |
| D | LYS62 |
| D | SER63 |
| D | ARG65 |
| D | MET66 |
| site_id | AC9 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 D 202 |
| Chain | Residue |
| D | LYS62 |
| D | FAD201 |
| E | ARG95 |
| E | FAD201 |
| site_id | BC1 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 D 203 |
| Chain | Residue |
| D | ARG17 |
| D | GLN18 |
| E | ARG65 |
| E | MET97 |
| site_id | BC2 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE SO4 D 204 |
| Chain | Residue |
| D | ARG65 |
| D | MET97 |
| D | HOH320 |
| E | ARG17 |
| E | GLN18 |
| site_id | BC3 |
| Number of Residues | 24 |
| Details | BINDING SITE FOR RESIDUE FAD E 201 |
| Chain | Residue |
| A | SER49 |
| A | LEU52 |
| D | VAL20 |
| D | LYS62 |
| D | NO3202 |
| D | HOH310 |
| D | HOH311 |
| E | HIS40 |
| E | MET42 |
| E | THR43 |
| E | VAL44 |
| E | ASN45 |
| E | SER46 |
| E | SER60 |
| E | LEU61 |
| E | LYS62 |
| E | SER63 |
| E | ARG65 |
| E | MET66 |
| E | SER93 |
| E | LYS94 |
| E | ARG95 |
| E | NO3202 |
| E | HOH317 |
| site_id | BC4 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 E 202 |
| Chain | Residue |
| D | ARG95 |
| D | FAD201 |
| E | LYS62 |
| E | FAD201 |
| site_id | BC5 |
| Number of Residues | 25 |
| Details | BINDING SITE FOR RESIDUE FAD F 500 |
| Chain | Residue |
| A | ARG17 |
| A | VAL20 |
| A | ARG95 |
| A | NO3202 |
| A | NO3203 |
| D | SER49 |
| D | ILE50 |
| F | HIS40 |
| F | MET42 |
| F | THR43 |
| F | VAL44 |
| F | ASN45 |
| F | SER46 |
| F | SER60 |
| F | LEU61 |
| F | LYS62 |
| F | SER63 |
| F | GLY64 |
| F | ARG65 |
| F | MET66 |
| F | SER93 |
| F | LYS94 |
| F | ARG95 |
| F | HOH605 |
| F | HOH641 |
| site_id | BC6 |
| Number of Residues | 24 |
| Details | BINDING SITE FOR RESIDUE FAD G 201 |
| Chain | Residue |
| B | ARG17 |
| B | VAL20 |
| B | LYS62 |
| B | ARG95 |
| B | NO3202 |
| B | HOH346 |
| C | SER49 |
| C | LEU52 |
| G | HIS40 |
| G | MET42 |
| G | THR43 |
| G | VAL44 |
| G | ASN45 |
| G | SER46 |
| G | SER60 |
| G | LEU61 |
| G | LYS62 |
| G | SER63 |
| G | ARG65 |
| G | MET66 |
| G | SER93 |
| G | ARG95 |
| G | NO3202 |
| G | HOH334 |
| site_id | BC7 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 G 202 |
| Chain | Residue |
| B | ARG95 |
| B | FAD201 |
| G | LYS62 |
| G | FAD201 |
| site_id | BC8 |
| Number of Residues | 23 |
| Details | BINDING SITE FOR RESIDUE FAD H 201 |
| Chain | Residue |
| B | SER49 |
| B | LEU52 |
| C | ARG17 |
| C | VAL20 |
| C | ARG95 |
| C | NO3202 |
| C | HOH303 |
| H | HIS40 |
| H | MET42 |
| H | THR43 |
| H | VAL44 |
| H | ASN45 |
| H | SER46 |
| H | SER60 |
| H | LEU61 |
| H | LYS62 |
| H | SER63 |
| H | ARG65 |
| H | MET66 |
| H | SER93 |
| H | ARG95 |
| H | NO3202 |
| H | HOH335 |
| site_id | BC9 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 H 202 |
| Chain | Residue |
| C | LYS62 |
| C | FAD201 |
| H | ARG95 |
| H | FAD201 |
| site_id | CC1 |
| Number of Residues | 27 |
| Details | BINDING SITE FOR RESIDUE FAD I 201 |
| Chain | Residue |
| I | HIS40 |
| I | MET42 |
| I | THR43 |
| I | VAL44 |
| I | ASN45 |
| I | SER46 |
| I | SER60 |
| I | LEU61 |
| I | LYS62 |
| I | SER63 |
| I | ARG65 |
| I | MET66 |
| I | SER93 |
| I | ARG95 |
| I | NO3202 |
| I | HOH303 |
| I | HOH347 |
| I | HOH350 |
| K | SER49 |
| K | ILE50 |
| K | LEU52 |
| L | VAL20 |
| L | LYS62 |
| L | NO3202 |
| L | HOH313 |
| L | HOH326 |
| L | HOH350 |
| site_id | CC2 |
| Number of Residues | 5 |
| Details | BINDING SITE FOR RESIDUE NO3 I 202 |
| Chain | Residue |
| I | LYS62 |
| I | FAD201 |
| I | HOH319 |
| L | ARG95 |
| L | FAD201 |
| site_id | CC3 |
| Number of Residues | 27 |
| Details | BINDING SITE FOR RESIDUE FAD J 201 |
| Chain | Residue |
| J | HIS40 |
| J | MET42 |
| J | THR43 |
| J | VAL44 |
| J | ASN45 |
| J | SER46 |
| J | SER60 |
| J | LEU61 |
| J | LYS62 |
| J | SER63 |
| J | ARG65 |
| J | MET66 |
| J | SER93 |
| J | LYS94 |
| J | ARG95 |
| J | NO3202 |
| J | NO3203 |
| J | HOH302 |
| J | HOH342 |
| J | HOH365 |
| K | ARG17 |
| K | VAL20 |
| K | LYS62 |
| K | HOH613 |
| L | SER49 |
| L | ILE50 |
| L | LEU52 |
| site_id | CC4 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 J 202 |
| Chain | Residue |
| J | LYS62 |
| J | FAD201 |
| K | ARG95 |
| K | FAD500 |
| site_id | CC5 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 J 203 |
| Chain | Residue |
| J | ARG95 |
| J | FAD201 |
| K | LYS62 |
| K | FAD500 |
| site_id | CC6 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE SO4 J 204 |
| Chain | Residue |
| J | ARG65 |
| J | MET97 |
| K | ARG17 |
| K | GLN18 |
| site_id | CC7 |
| Number of Residues | 25 |
| Details | BINDING SITE FOR RESIDUE FAD K 500 |
| Chain | Residue |
| I | SER49 |
| I | LEU52 |
| J | ARG17 |
| J | VAL20 |
| J | ARG95 |
| J | NO3202 |
| J | NO3203 |
| K | HIS40 |
| K | MET42 |
| K | THR43 |
| K | VAL44 |
| K | ASN45 |
| K | SER46 |
| K | SER60 |
| K | LEU61 |
| K | LYS62 |
| K | SER63 |
| K | ARG65 |
| K | MET66 |
| K | SER93 |
| K | ARG95 |
| K | HOH603 |
| K | HOH611 |
| K | HOH624 |
| K | HOH654 |
| site_id | CC8 |
| Number of Residues | 23 |
| Details | BINDING SITE FOR RESIDUE FAD L 201 |
| Chain | Residue |
| I | ARG17 |
| I | VAL20 |
| I | NO3202 |
| I | HOH319 |
| I | HOH324 |
| I | HOH339 |
| J | SER49 |
| L | MET42 |
| L | THR43 |
| L | VAL44 |
| L | ASN45 |
| L | SER46 |
| L | SER60 |
| L | LEU61 |
| L | LYS62 |
| L | SER63 |
| L | ARG65 |
| L | SER93 |
| L | ARG95 |
| L | PHE157 |
| L | NO3202 |
| L | HOH303 |
| L | HOH364 |
| site_id | CC9 |
| Number of Residues | 4 |
| Details | BINDING SITE FOR RESIDUE NO3 L 202 |
| Chain | Residue |
| I | ARG95 |
| I | FAD201 |
| L | LYS62 |
| L | FAD201 |
