3WWJ
Crystal structure of an engineered sitagliptin-producing transaminase, ATA-117-Rd11
Functional Information from GO Data
| Chain | GOid | namespace | contents |
| A | 0003824 | molecular_function | catalytic activity |
| A | 0019752 | biological_process | carboxylic acid metabolic process |
| A | 0046394 | biological_process | carboxylic acid biosynthetic process |
| B | 0003824 | molecular_function | catalytic activity |
| B | 0019752 | biological_process | carboxylic acid metabolic process |
| B | 0046394 | biological_process | carboxylic acid biosynthetic process |
| C | 0003824 | molecular_function | catalytic activity |
| C | 0019752 | biological_process | carboxylic acid metabolic process |
| C | 0046394 | biological_process | carboxylic acid biosynthetic process |
| D | 0003824 | molecular_function | catalytic activity |
| D | 0019752 | biological_process | carboxylic acid metabolic process |
| D | 0046394 | biological_process | carboxylic acid biosynthetic process |
| E | 0003824 | molecular_function | catalytic activity |
| E | 0019752 | biological_process | carboxylic acid metabolic process |
| E | 0046394 | biological_process | carboxylic acid biosynthetic process |
| F | 0003824 | molecular_function | catalytic activity |
| F | 0019752 | biological_process | carboxylic acid metabolic process |
| F | 0046394 | biological_process | carboxylic acid biosynthetic process |
| G | 0003824 | molecular_function | catalytic activity |
| G | 0019752 | biological_process | carboxylic acid metabolic process |
| G | 0046394 | biological_process | carboxylic acid biosynthetic process |
| H | 0003824 | molecular_function | catalytic activity |
| H | 0019752 | biological_process | carboxylic acid metabolic process |
| H | 0046394 | biological_process | carboxylic acid biosynthetic process |
| I | 0003824 | molecular_function | catalytic activity |
| I | 0019752 | biological_process | carboxylic acid metabolic process |
| I | 0046394 | biological_process | carboxylic acid biosynthetic process |
| J | 0003824 | molecular_function | catalytic activity |
| J | 0019752 | biological_process | carboxylic acid metabolic process |
| J | 0046394 | biological_process | carboxylic acid biosynthetic process |
| K | 0003824 | molecular_function | catalytic activity |
| K | 0019752 | biological_process | carboxylic acid metabolic process |
| K | 0046394 | biological_process | carboxylic acid biosynthetic process |
| L | 0003824 | molecular_function | catalytic activity |
| L | 0019752 | biological_process | carboxylic acid metabolic process |
| L | 0046394 | biological_process | carboxylic acid biosynthetic process |
Functional Information from PDB Data
| site_id | AC1 |
| Number of Residues | 16 |
| Details | BINDING SITE FOR RESIDUE PLP A 401 |
| Chain | Residue |
| A | ARG86 |
| A | THR247 |
| A | THR283 |
| A | HOH502 |
| A | HOH507 |
| A | HOH535 |
| A | HOH664 |
| A | HOH669 |
| A | LYS188 |
| A | TRP192 |
| A | GLU221 |
| A | GLY224 |
| A | ASN226 |
| A | LEU243 |
| A | GLY245 |
| A | ILE246 |
| site_id | AC2 |
| Number of Residues | 18 |
| Details | BINDING SITE FOR RESIDUE PLP B 401 |
| Chain | Residue |
| B | ARG86 |
| B | LYS188 |
| B | TRP192 |
| B | GLU221 |
| B | GLY222 |
| B | GLY224 |
| B | PHE225 |
| B | ASN226 |
| B | LEU243 |
| B | GLY245 |
| B | ILE246 |
| B | THR247 |
| B | THR283 |
| B | HOH505 |
| B | HOH526 |
| B | HOH540 |
| B | HOH629 |
| B | HOH644 |
| site_id | AC3 |
| Number of Residues | 16 |
| Details | BINDING SITE FOR RESIDUE PLP C 401 |
| Chain | Residue |
| C | ARG86 |
| C | LYS188 |
| C | GLU221 |
| C | GLY222 |
| C | GLY224 |
| C | PHE225 |
| C | ASN226 |
| C | LEU243 |
| C | GLY245 |
| C | ILE246 |
| C | THR247 |
| C | THR283 |
| C | HOH505 |
| C | HOH515 |
| C | HOH532 |
| C | HOH614 |
| site_id | AC4 |
| Number of Residues | 13 |
| Details | BINDING SITE FOR RESIDUE PLP D 401 |
| Chain | Residue |
| D | ARG86 |
| D | LYS188 |
| D | GLU221 |
| D | GLY224 |
| D | LEU243 |
| D | GLY245 |
| D | ILE246 |
| D | THR247 |
| D | THR283 |
| D | HOH508 |
| D | HOH528 |
| D | HOH536 |
| D | HOH606 |
| site_id | AC5 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE PLP E 401 |
| Chain | Residue |
| E | ARG86 |
| E | LYS188 |
| E | TRP192 |
| E | GLU221 |
| E | GLY224 |
| E | PHE225 |
| E | LEU243 |
| E | GLY245 |
| E | ILE246 |
| E | THR247 |
| E | THR283 |
| E | HOH506 |
| E | HOH514 |
| E | HOH541 |
| E | HOH575 |
| site_id | AC6 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE PLP F 401 |
| Chain | Residue |
| F | ARG86 |
| F | LYS188 |
| F | GLU221 |
| F | GLY224 |
| F | ASN226 |
| F | LEU243 |
| F | GLY245 |
| F | ILE246 |
| F | THR247 |
| F | THR283 |
| F | HOH504 |
| F | HOH518 |
| F | HOH555 |
| F | HOH586 |
| F | HOH611 |
| site_id | AC7 |
| Number of Residues | 15 |
| Details | BINDING SITE FOR RESIDUE PLP G 401 |
| Chain | Residue |
| G | LEU243 |
| G | GLY245 |
| G | ILE246 |
| G | THR247 |
| G | THR283 |
| G | HOH505 |
| G | HOH535 |
| G | HOH536 |
| G | HOH691 |
| G | ARG86 |
| G | LYS188 |
| G | GLU221 |
| G | GLY224 |
| G | PHE225 |
| G | ASN226 |
| site_id | AC8 |
| Number of Residues | 17 |
| Details | BINDING SITE FOR RESIDUE PLP H 401 |
| Chain | Residue |
| H | ARG86 |
| H | LYS188 |
| H | TRP192 |
| H | GLU221 |
| H | GLY224 |
| H | PHE225 |
| H | ASN226 |
| H | LEU243 |
| H | GLY245 |
| H | ILE246 |
| H | THR247 |
| H | THR283 |
| H | HOH529 |
| H | HOH532 |
| H | HOH538 |
| H | HOH603 |
| H | HOH663 |
| site_id | AC9 |
| Number of Residues | 17 |
| Details | BINDING SITE FOR RESIDUE PLP I 401 |
| Chain | Residue |
| I | ARG86 |
| I | LYS188 |
| I | TRP192 |
| I | GLU221 |
| I | GLY224 |
| I | PHE225 |
| I | ASN226 |
| I | LEU243 |
| I | GLY245 |
| I | ILE246 |
| I | THR247 |
| I | THR283 |
| I | HOH511 |
| I | HOH517 |
| I | HOH535 |
| I | HOH573 |
| I | HOH609 |
| site_id | BC1 |
| Number of Residues | 16 |
| Details | BINDING SITE FOR RESIDUE PLP J 401 |
| Chain | Residue |
| J | ARG86 |
| J | LYS188 |
| J | GLU221 |
| J | GLY224 |
| J | PHE225 |
| J | ASN226 |
| J | LEU243 |
| J | GLY245 |
| J | ILE246 |
| J | THR247 |
| J | THR283 |
| J | HOH505 |
| J | HOH552 |
| J | HOH568 |
| J | HOH588 |
| J | HOH601 |
| site_id | BC2 |
| Number of Residues | 16 |
| Details | BINDING SITE FOR RESIDUE PLP K 401 |
| Chain | Residue |
| K | ARG86 |
| K | LYS188 |
| K | TRP192 |
| K | GLU221 |
| K | GLY224 |
| K | ASN226 |
| K | LEU243 |
| K | GLY245 |
| K | ILE246 |
| K | THR247 |
| K | SER282 |
| K | THR283 |
| K | HOH536 |
| K | HOH539 |
| K | HOH555 |
| K | HOH578 |
| site_id | BC3 |
| Number of Residues | 16 |
| Details | BINDING SITE FOR RESIDUE PLP L 401 |
| Chain | Residue |
| L | ARG86 |
| L | LYS188 |
| L | GLU221 |
| L | GLY224 |
| L | PHE225 |
| L | ASN226 |
| L | LEU243 |
| L | GLY245 |
| L | ILE246 |
| L | THR247 |
| L | SER282 |
| L | THR283 |
| L | HOH525 |
| L | HOH536 |
| L | HOH540 |
| L | HOH572 |
