DrugDomain

Attributes

UniProt ID

P22734

Protein Name

Catechol O-methyltransferase

Ligand Name

S-ADENOSYL-L-HOMOCYSTEINE

DrugBank ID

DB01752

PDB Ligand Accession

SAH

ChEMBL ID

n/a

PubChem ID

n/a

InChIKey

ZJUKTBDSGOFHSH-WFMPWKQPSA-N

SMILES

c1nc(c2c(n1)n(cn2)C3C(C(C(O3)CSCCC(C(=O)O)N)O)O)N

Drug Action

No data available

Affinity Metrics

No affinity data available

3D Structure

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Mol*

Structure: 3U81

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Color Legend

Unassigned regionsLigand / hetero atomse3u81A1

ECOD domains from experimental PDB structures interacting with ligand DB01752

UniProt	DrugBank	PDB Ligand	PDB ID	ECOD Domain	Range Definition
P22734	DB01752	SAH	3u81	e3u81A1	A:1-213
P22734	DB01752	SAH	4pyn	e4pynA1	A:45-263
P22734	DB01752	SAH	4pyo	e4pyoA1	A:46-259
P22734	DB01752	SAH	4pyo	e4pyoB1	B:45-259
P22734	DB01752	SAH	5p9o	e5p9oA1	A:3-215
P22734	DB01752	SAH	5p9p	e5p9pA1	A:3-215
P22734	DB01752	SAH	5p9q	e5p9qA1	A:3-215
P22734	DB01752	SAH	5p9r	e5p9rA1	A:2-215
P22734	DB01752	SAH	5p9r	e5p9rB1	B:2-215
P22734	DB01752	SAH	5p9s	e5p9sA1	A:3-216
P22734	DB01752	SAH	5p9t	e5p9tA1	A:3-215
P22734	DB01752	SAH	5p9u	e5p9uA1	A:3-216
P22734	DB01752	SAH	5p9v	e5p9vA1	A:3-215
P22734	DB01752	SAH	5p9z	e5p9zA1	A:3-215
P22734	DB01752	SAH	5pa0	e5pa0A1	A:3-215
P22734	DB01752	SAH	5pa1	e5pa1A1	A:3-215
P22734	DB01752	SAH	5pa2	e5pa2A1	A:3-215
P22734	DB01752	SAH	5pa3	e5pa3A1	A:3-215
P22734	DB01752	SAH	5pa4	e5pa4A1	A:3-215
P22734	DB01752	SAH	5pa5	e5pa5A1	A:3-215
P22734	DB01752	SAH	5pa6	e5pa6A1	A:3-215
P22734	DB01752	SAH	5pa7	e5pa7A1	A:3-215
P22734	DB01752	SAH	5pa7	e5pa7B1	B:3-216
P22734	DB01752	SAH	6gy1	e6gy1A1	A:3-214
P22734	DB01752	SAH	7xgi	e7xgiA1	A:3-215