DrugDomain logoDrugDomain

Attributes

UniProt ID
G2IQS7
Protein Name
Vanillate/3-O-methylgallate O-demethylase
Ligand Name
(6S)-5,6,7,8-TETRAHYDROFOLATE
DrugBank ID
DB02031
PDB Ligand Accession
THG
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MSTNYGQPCMXVAQ-RYUDHWBXSA-N
SMILES
c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)NCC2CNC3=C(N2)C(=O)NC(=N3)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Mol*
Structure: 5X1L
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Color Legend
Unassigned regionsLigand / hetero atomse5x1lA1e5x1lA2e5x1lA3e5x1lB1e5x1lB2e5x1lB3e5x1lC1e5x1lC2e5x1lC3
ECOD domains from experimental PDB structures interacting with ligand DB02031
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
G2IQS7DB02031THG5x1le5x1lB1B:60-152
G2IQS7DB02031THG5x1le5x1lB2B:3-59,B:153-328
G2IQS7DB02031THG5x1le5x1lC1C:4-59,C:153-328
G2IQS7DB02031THG5x1le5x1lC3C:60-152
G2IQS7DB02031THG5x1me5x1mB1B:3-59,B:153-328
G2IQS7DB02031THG5x1me5x1mB2B:60-152
G2IQS7DB02031THG5x1me5x1mC1C:60-152
G2IQS7DB02031THG5x1me5x1mC3C:3-59,C:153-328
G2IQS7DB02031THG5x1ne5x1nA1A:60-152
G2IQS7DB02031THG5x1ne5x1nA2A:2-59,A:153-328
G2IQS7DB02031THG5x1ne5x1nB1B:60-152
G2IQS7DB02031THG5x1ne5x1nB3B:2-59,B:153-328