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Attributes

UniProt ID
Protein Name
Flavin-dependent thymidylate synthase
Ligand Name
N-({4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-hexahydroimidazo[1,5-f]pteridin-8(9H)-yl]phenyl}carbonyl)-L-glutamic acid
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
QYNUQALWYRSVHF-OLZOCXBDSA-N
SMILES
c1cc(ccc1C(=O)NC(CCC(=O)O)C(=O)O)N2CC3CNC4=C(N3C2)C(=O)NC(=N4)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4GT9
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Color Legend
Unassigned regionsLigand / hetero atomse4gt9A1
ECOD domains from experimental PDB structures interacting with ligand DB12676
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q9WYT0DB12676MEF4gt9e4gt9A1A:-11-216
Q9WYT0DB12676MEF4gtee4gteA1A:-11-202
Q9WYT0DB12676MEF4gtee4gteB1B:-11-202
Q9WYT0DB12676MEF4gtee4gteC1C:-11-202
Q9WYT0DB12676MEF4gtee4gteD1D:-11-202
Q9WYT0DB12676MEF4gtfe4gtfA1A:-11-202