Functional Information from GO Data
Chain | GOid | namespace | contents |
A | 0000287 | molecular_function | magnesium ion binding |
A | 0006584 | biological_process | catecholamine metabolic process |
A | 0008171 | molecular_function | O-methyltransferase activity |
A | 0016206 | molecular_function | catechol O-methyltransferase activity |
Functional Information from PDB Data
site_id | AC1 |
Number of Residues | 5 |
Details | binding site for residue MG A 301 |
Chain | Residue |
A | ASP141 |
A | ASP169 |
A | ASN170 |
A | 7JU305 |
A | HOH428 |
site_id | AC2 |
Number of Residues | 4 |
Details | binding site for residue CL A 302 |
Chain | Residue |
A | ASP44 |
A | ALA45 |
A | TYR200 |
A | HOH555 |
site_id | AC3 |
Number of Residues | 5 |
Details | binding site for residue SO4 A 303 |
Chain | Residue |
A | PRO82 |
A | GLY83 |
A | ARG85 |
A | LYS111 |
A | LYS128 |
site_id | AC4 |
Number of Residues | 24 |
Details | binding site for residue SAH A 304 |
Chain | Residue |
A | MET40 |
A | ASN41 |
A | VAL42 |
A | GLY66 |
A | ALA67 |
A | TYR68 |
A | TYR71 |
A | SER72 |
A | MET89 |
A | GLU90 |
A | ILE91 |
A | GLY117 |
A | ALA118 |
A | SER119 |
A | GLN120 |
A | ASP141 |
A | HIS142 |
A | ARG146 |
A | 7JU305 |
A | HOH444 |
A | HOH465 |
A | HOH567 |
A | HOH588 |
A | HOH597 |
site_id | AC5 |
Number of Residues | 17 |
Details | binding site for residue 7JU A 305 |
Chain | Residue |
A | TRP38 |
A | MET40 |
A | ALA97 |
A | GLN100 |
A | GLN101 |
A | ASP141 |
A | HIS142 |
A | TRP143 |
A | ASP169 |
A | ASN170 |
A | LEU198 |
A | GLU199 |
A | MG301 |
A | SAH304 |
A | D1D307 |
A | HOH428 |
A | HOH497 |
site_id | AC6 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AC7 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AC8 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | HOH410 |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
site_id | AC9 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AD1 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AD2 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AD3 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AD4 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AD5 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AD6 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
site_id | AD7 |
Number of Residues | 15 |
Details | binding site for residues NHE A 306 and D1D A 307 |
Chain | Residue |
A | GLU37 |
A | TRP38 |
A | TRP38 |
A | ALA96 |
A | ALA97 |
A | GLN100 |
A | GLN100 |
A | ILE114 |
A | ILE114 |
A | LEU115 |
A | MET201 |
A | MET201 |
A | 7JU305 |
A | HOH410 |
A | HOH410 |
Functional Information from SwissProt/UniProt
Chain | Residue | Details |
A | VAL42 | |
A | SER72 | |
A | GLU90 | |
A | ASP141 | |
Chain | Residue | Details |
A | GLU64 | |
A | ILE91 | |
A | SER119 | |
site_id | SWS_FT_FI3 |
Number of Residues | 5 |
Details | BINDING: |
Chain | Residue | Details |
A | GLY117 | |
A | LYS144 | |
A | ASP169 | |
A | ASN170 | |
A | GLU199 | |
Chain | Residue | Details |
A | SER216 | |
A | SER217 | |
A | SER221 | |
Catalytic Information from CSA
site_id | MCSA1 |
Number of Residues | 5 |
Details | M-CSA 915 |
Chain | Residue | Details |
A | ASP141 | metal ligand |
A | LYS144 | proton shuttle (general acid/base) |
A | ASP169 | metal ligand |
A | ASN170 | metal ligand |
A | GLU199 | electrostatic stabiliser |