6I3D
Crystal structure of Human soluble catechol O-methyltransferase in complex with 3,5-dinitrocatechol and Sinefungin
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | Catechol O-methyltransferase | polymer | 232 | 25970.6 | 2 | UniProt (P21964) Pfam (PF01596) In PDB | Homo sapiens (Human) | |
2 | A, B | 3,5-DINITROCATECHOL | non-polymer | 200.1 | 2 | Chemie (DNC) | |||
3 | A, B | MAGNESIUM ION | non-polymer | 24.3 | 2 | Chemie (MG) | |||
4 | A, B | SINEFUNGIN | non-polymer | 381.4 | 2 | Chemie (SFG) | |||
5 | water | water | 18.0 | 421 | Chemie (HOH) |
Sequence modifications
A, B: 2 - 221 (UniProt: P21964)
PDB | External Database | Details |
---|---|---|
His -10 | - | expression tag |
His -9 | - | expression tag |
His -8 | - | expression tag |
His -7 | - | expression tag |
His -6 | - | expression tag |
His -5 | - | expression tag |
Glu -4 | - | expression tag |
Asn -3 | - | expression tag |
Leu -2 | - | expression tag |
Tyr -1 | - | expression tag |
Phe 0 | - | expression tag |
Gln 1 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 51941.2 | |
Non-Polymers* | Number of molecules | 6 |
Total formula weight | 1211.6 | |
All* | Total formula weight | 53152.8 |