PDB ligand accession: NAD
DrugBank: DB14128
PubChem: 5892;5288979;10897651;73415790;
ChEMBL:
InChI Key: BAWFJGJZGIEFAR-NNYOXOHSSA-N
SMILES: c1cc(c[n+](c1)C2C(C(C(O2)COP(=O)([O-])OP(=O)(O)OCC3C(C(C(O3)n4cnc5c4ncnc5N)O)O)O)O)C(=O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: (5'->5')-dinucleotides
- Subclass: None
- Class: (5'->5')-dinucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1U1I | Download | Experimental | e1u1iA1 e1u1iA2 e1u1iB1 e1u1iB2 e1u1iC1 e1u1iC2 e1u1iD1 e1u1iD2 | FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like | LigPlot |
3QW2 | Download | Experimental | e3qw2A1 e3qw2A2 e3qw2B1 e3qw2B2 e3qw2C1 e3qw2C2 e3qw2D1 e3qw2D2 | FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like FwdE/GAPDH domain-like Rossmann-like | LigPlot |
3QVS | Download | Experimental | e3qvsA1 e3qvsA2 | FwdE/GAPDH domain-like Rossmann-like | LigPlot |
3QVW | Download | Experimental | e3qvwA1 e3qvwA2 | FwdE/GAPDH domain-like Rossmann-like | LigPlot |
3QVX | Download | Experimental | e3qvxA1 e3qvxA2 | FwdE/GAPDH domain-like Rossmann-like | LigPlot |