PDB ligand accession: FAD
DrugBank: DB03147
PubChem:
ChEMBL:
InChI Key: VWWQXMAJTJZDQX-UYBVJOGSSA-N
SMILES: Cc1cc2c(cc1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)n5cnc6c5ncnc6N)O)O)O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Nucleosides, nucleotides, and analogues
- Class: Flavin nucleotides
- Subclass: None
- Class: Flavin nucleotides
- Superclass: Nucleosides, nucleotides, and analogues
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6X9A | Download | Experimental | e6x9aA2 e6x9aA3 e6x9aB1 e6x9aB5 | ALDH-like TIM beta/alpha-barrel ALDH-like TIM beta/alpha-barrel | LigPlot |
6X9B | Download | Experimental | e6x9bA2 e6x9bA4 e6x9bB1 e6x9bB5 | ALDH-like TIM beta/alpha-barrel ALDH-like TIM beta/alpha-barrel | LigPlot |
8DKO | Download | Experimental | e8dkoA1 e8dkoB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
8DKQ | Download | Experimental | e8dkqA2 e8dkqB2 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
6X9D | Download | Experimental | e6x9dA3 e6x9dA5 e6x9dB2 e6x9dB5 | ALDH-like TIM beta/alpha-barrel TIM beta/alpha-barrel ALDH-like | LigPlot |
6VZ9 | Download | Experimental | e6vz9A2 e6vz9A4 e6vz9B1 e6vz9B5 | ALDH-like TIM beta/alpha-barrel TIM beta/alpha-barrel ALDH-like | LigPlot |
8DKP | Download | Experimental | e8dkpA1 e8dkpB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
5KF7 | Download | Experimental | e5kf7A5 | TIM beta/alpha-barrel | LigPlot |
6X99 | Download | Experimental | e6x99A2 e6x99A3 e6x99B2 e6x99B5 | TIM beta/alpha-barrel ALDH-like TIM beta/alpha-barrel ALDH-like | LigPlot |
7MYB | Download | Experimental | e7mybA1 e7mybA5 e7mybB1 e7mybB5 | TIM beta/alpha-barrel ALDH-like TIM beta/alpha-barrel ALDH-like | LigPlot |
5KF6 | Download | Experimental | e5kf6A2 e5kf6B5 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
7MY9 | Download | Experimental | e7my9A1 e7my9A5 e7my9B1 e7my9B5 | TIM beta/alpha-barrel ALDH-like TIM beta/alpha-barrel ALDH-like | LigPlot |