DrugDomain logoDrugDomain

Attributes

UniProt ID
Q5CGA3
Protein Name
deleted
Ligand Name
METHOTREXATE
DrugBank ID
DB00563
PDB Ligand Accession
MTX
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FBOZXECLQNJBKD-ZDUSSCGKSA-N
SMILES
CN(Cc1cnc2c(n1)c(nc(n2)N)N)c3ccc(cc3)C(=O)NC(CCC(=O)O)C(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Mol*
Structure: 2OIP
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Color Legend
Unassigned regionsLigand / hetero atomse2oipA2e2oipA3e2oipB2e2oipB3e2oipC1e2oipC2e2oipD2e2oipD3e2oipE2e2oipE3
ECOD domains from experimental PDB structures interacting with ligand DB00563
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q5CGA3DB00563MTX2oipe2oipA3A:3-184
Q5CGA3DB00563MTX2oipe2oipB3B:3-184
Q5CGA3DB00563MTX2oipe2oipC2C:3-184
Q5CGA3DB00563MTX2oipe2oipD3D:3-184
Q5CGA3DB00563MTX2oipe2oipE3E:3-184
Q5CGA3DB00563MTX3hj3e3hj3A2A:3-179
Q5CGA3DB00563MTX3hj3e3hj3B3B:3-180
Q5CGA3DB00563MTX3hj3e3hj3C1C:3-180
Q5CGA3DB00563MTX3hj3e3hj3D2D:3-178
Q5CGA3DB00563MTX4ky8e4ky8A2A:3-177
Q5CGA3DB00563MTX4ky8e4ky8B2B:3-177
Q5CGA3DB00563MTX4ky8e4ky8C2C:3-177
Q5CGA3DB00563MTX4ky8e4ky8D2D:3-177
Q5CGA3DB00563MTX4ky8e4ky8E2E:3-177
Q5CGA3DB00563MTX4q0de4q0dA1A:3-181
Q5CGA3DB00563MTX4q0de4q0dB1B:3-181
Q5CGA3DB00563MTX4q0de4q0dC1C:3-181
Q5CGA3DB00563MTX4q0de4q0dD1D:3-181
Q5CGA3DB00563MTX4q0de4q0dE1E:3-181