PDB ligand accession: CIT
DrugBank: DB04272
PubChem: 311;19782904;88113319;
ChEMBL:
InChI Key: KRKNYBCHXYNGOX-UHFFFAOYSA-N
SMILES: C(C(=O)O)C(CC(=O)O)(C(=O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Tricarboxylic acids and derivatives
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 6RGB | Download | Experimental | e6rgbA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6Z64 | Download | Experimental | e6z64A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 5DHP | Download | Experimental | e5dhpA2 e5dhpB1 e5dhpC2 e5dhpD2 | NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like | LigPlot |
| 6RGE | Download | Experimental | e6rgeA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RG6 | Download | Experimental | e6rg6A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 4DY6 | Download | Experimental | e4dy6A1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RC5 | Download | Experimental | e6rc5A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 5EJI | Download | Experimental | e5ejiA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZJ | Download | Experimental | e7zzjA1 | Flavodoxin-like | LigPlot |
| 6RBQ | Download | Experimental | e6rbqA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RC0 | Download | Experimental | e6rc0A1 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V8N | Download | Experimental | e3v8nA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V8R | Download | Experimental | e3v8rA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RGF | Download | Experimental | e6rgfA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 2I29 | Download | Experimental | e2i29A3 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZE | Download | Experimental | e7zzeA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZC | Download | Experimental | e7zzcA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZD | Download | Experimental | e7zzdA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBU | Download | Experimental | e6rbuA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RC4 | Download | Experimental | e6rc4A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 5EJH | Download | Experimental | e5ejhA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBY | Download | Experimental | e6rbyA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZG | Download | Experimental | e7zzgA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6Z65 | Download | Experimental | e6z65A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBW | Download | Experimental | e6rbwA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6Z61 | Download | Experimental | e6z61A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RG9 | Download | Experimental | e6rg9A1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RC2 | Download | Experimental | e6rc2A1 | NAD kinase beta sandwich domain-like | LigPlot |
| 2I2B | Download | Experimental | e2i2bA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V80 | Download | Experimental | e3v80A1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RGA | Download | Experimental | e6rgaA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RC1 | Download | Experimental | e6rc1A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBZ | Download | Experimental | e6rbzA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V7Y | Download | Experimental | e3v7yA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 8A9V | Download | Experimental | e8a9vA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 5DHT | Download | Experimental | e5dhtA1 e5dhtB2 | NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like | LigPlot |
| 6RGD | Download | Experimental | e6rgdA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 5DHS | Download | Experimental | e5dhsA1 e5dhsB1 e5dhsB1 | NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZ7 | Download | Experimental | e7zz7A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RC3 | Download | Experimental | e6rc3A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBX | Download | Experimental | e6rbxA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBV | Download | Experimental | e6rbvA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZB | Download | Experimental | e7zzbA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V8M | Download | Experimental | e3v8mA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZH | Download | Experimental | e7zzhA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 5DHU | Download | Experimental | e5dhuA1 e5dhuB1 | NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like | LigPlot |
| 5DHR | Download | Experimental | e5dhrA2 e5dhrB1 e5dhrB1 | NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like | LigPlot |
| 6RBO | Download | Experimental | e6rboA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZF | Download | Experimental | e7zzfA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 2I2D | Download | Experimental | e2i2dA3 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V7W | Download | Experimental | e3v7wA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RGC | Download | Experimental | e6rgcA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBS | Download | Experimental | e6rbsA2 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZA | Download | Experimental | e7zzaA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V8P | Download | Experimental | e3v8pA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBR | Download | Experimental | e6rbrA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V7U | Download | Experimental | e3v7uA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RG8 | Download | Experimental | e6rg8A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 3V8Q | Download | Experimental | e3v8qA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RBP | Download | Experimental | e6rbpA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RC6 | Download | Experimental | e6rc6A1 | NAD kinase beta sandwich domain-like | LigPlot |
| 5DHQ | Download | Experimental | e5dhqA1 e5dhqB2 | NAD kinase beta sandwich domain-like NAD kinase beta sandwich domain-like | LigPlot |
| 6RBT | Download | Experimental | e6rbtA1 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RG7 | Download | Experimental | e6rg7A2 | NAD kinase beta sandwich domain-like | LigPlot |
| 6RR2 | Download | Experimental | e6rr2A1 | NAD kinase beta sandwich domain-like | LigPlot |
| 7ZZ9 | Download | Experimental | e7zz9A2 | NAD kinase beta sandwich domain-like | LigPlot |