Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00053410
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
GKR | D-GLUCARATE | A | 3CXT | 0.72 | |
GKR | D-GLUCARATE | A,B | 1JCT | 0.72 | |
3HL | (3S)-3-HYDROXYBUTANOIC ACID | A | 2ECQ | 0.77 | |
3HL | (3S)-3-HYDROXYBUTANOIC ACID | A,B,C,D | 3EEW | 0.77 | |
3HG | 3-HYDROXYPENTANEDIOIC ACID | A,B,C,D,E,F | 2CW6 | 0.97 | |
CS2 | D-MANNONIC ACID | A,B,C,D | 2QJM | 0.73 | |
CS2 | D-MANNONIC ACID | A,B | 3DBN | 0.73 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 1YBA | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1DS1 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1H2L | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C | 1NX8 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BUC | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2RDN | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BIE | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,D | 1OIK | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 3DC1 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FDF | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 3D8C | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1DRY | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FDH | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C | 2J9E | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 2QFY | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1UNB | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 1OIJ | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 2QFX | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1GQW | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BKZ | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2GP5 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3GJB | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1GP4 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2RDQ | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D,E,F | 1HWY | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2VDC | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BU0 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FCT | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,F,G | 2Q8C | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1GY9 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 1OII | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2A1X | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1H2N | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C | 1NX4 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2BRT | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FCV | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FDI | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2YU1 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FDK | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1E5I | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1UOB | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1OFE | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2ILM | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FCU | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1AIB | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1RXG | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1MZF | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1EA0 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1DRT | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2IUW | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 3BN1 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 2FD8 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2JJH | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1IKA | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B,C,D | 1OS7 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1MDX | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 1OFD | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2CJH | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1GP5 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1CW4 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A,B | 3BI3 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1BL5 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1LLW | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 2ZE3 | 0.71 | |
AKG | 2-OXYGLUTARIC ACID | A | 1GVG | 0.71 | |
ICT | ISOCITRIC ACID | A | 1IDE | 0.76 | |
ICT | ISOCITRIC ACID | A,B | 2UXR | 0.76 | |
ICT | ISOCITRIC ACID | A,B | 1XKD | 0.76 | |
ICT | ISOCITRIC ACID | A | 8ICD | 0.76 | |
ICT | ISOCITRIC ACID | A,B,D | 1XG4 | 0.76 | |
ICT | ISOCITRIC ACID | A | 1CW7 | 0.76 | |
ICT | ISOCITRIC ACID | A | 1GRO | 0.76 | |
ICT | ISOCITRIC ACID | A | 1W8G | 0.76 | |
ICT | ISOCITRIC ACID | A | 5ICD | 0.76 | |
ICT | ISOCITRIC ACID | A,B | 1LWD | 0.76 | |
ICT | ISOCITRIC ACID | A,B,C,D | 1ITW | 0.76 | |
ICT | ISOCITRIC ACID | A,B,C,D | 1T0L | 0.76 | |
ICT | ISOCITRIC ACID | A | 1PB1 | 0.76 | |
ICT | ISOCITRIC ACID | A | 1GRP | 0.76 | |
ICT | ISOCITRIC ACID | A | 1CW1 | 0.76 | |
ICT | ISOCITRIC ACID | A,B,C,D,E,F | 2QFW | 0.76 | |
ICT | ISOCITRIC ACID | A | 1B0J | 0.76 | |
ICT | ISOCITRIC ACID | A | 1W7F | 0.76 | |
ICT | ISOCITRIC ACID | A | 7ACN | 0.76 | |
ICT | ISOCITRIC ACID | A | 1C97 | 0.76 | |
ICT | ISOCITRIC ACID | A | 1P8F | 0.76 | |
ICT | ISOCITRIC ACID | A | 2CSG | 0.76 | |
ITM | ISOCITRIC ACID-MAGNESIUM COMPLEX | A | 1AI3 | 0.75 | |
LMR | (2S)-2-hydroxybutanedioic acid | A | 3CSC | 0.7 | |
LMR | (2S)-2-hydroxybutanedioic acid | A,B | 2W98 | 0.7 | |
LMR | (2S)-2-hydroxybutanedioic acid | A | 1CSC | 0.7 | |
LMR | (2S)-2-hydroxybutanedioic acid | A,B | 3ES7 | 0.7 | |
LMR | (2S)-2-hydroxybutanedioic acid | A,B,C,D,E,F, G,H | 3ES8 | 0.7 | |
HKV | 4,5-DIOXOPENTANOIC ACID | A | 2JB8 | 0.74 | |
LFC | 6-DEOXY-L-GALACTONIC ACID | A | 2HXU | 0.72 | |
GCO | GLUCONIC ACID | B,C,D | 1BGG | 0.73 | |
GCO | GLUCONIC ACID | A,B | 1XLF | 0.73 | |
DXG | 4-DEOXYGLUCARATE | A,B,C,D | 1ECQ | 0.73 | |
GUA | GLUTARIC ACID | A,B | 1JW0 | 0.76 | |
GUA | GLUTARIC ACID | A,B,C,D | 1B4N | 0.76 | |
GUA | GLUTARIC ACID | A | 1AMS | 0.76 | |
GUA | GLUTARIC ACID | A,B | 1XEY | 0.76 | |
GUA | GLUTARIC ACID | A | 1CZC | 0.76 | |
GUA | GLUTARIC ACID | A,B,C | 1IYD | 0.76 | |
DMR | 2-HYDROXY-SUCCINIC ACID | A,B | 2YZO | 0.7 | |
DMR | 2-HYDROXY-SUCCINIC ACID | A | 4CSC | 0.7 | |
DMR | 2-HYDROXY-SUCCINIC ACID | H,L | 1C1E | 0.7 | |
DMR | 2-HYDROXY-SUCCINIC ACID | A | 2CSC | 0.7 | |
DMR | 2-HYDROXY-SUCCINIC ACID | A | 2AR9 | 0.7 | |
DMV | 2,3-DIHYDROXY-VALERIANIC ACID | A,B,C,D | 1QMG | 0.72 | |
LGT | L-GLUCARIC ACID | A,B,C,D | 3CB3 | 0.72 | |
LGT | L-GLUCARIC ACID | A,B,C | 2PP3 | 0.72 | |
DO4 | 2,5-DIOXOPENTANOIC ACID | X | 2Q1D | 0.72 | |
KDG | 2-KETO-3-DEOXYGLUCONATE | A,B | 1V1A | 0.72 | |
KDG | 2-KETO-3-DEOXYGLUCONATE | A,B,C | 2VAR | 0.72 | |
KDG | 2-KETO-3-DEOXYGLUCONATE | A,B,C,D | 2QJN | 0.72 | |
GLR | 2,3-DIHYDROXY-5-OXO-HEXANEDIOATE | A,B,C,D | 1EC8 | 0.74 | |
GLR | 2,3-DIHYDROXY-5-OXO-HEXANEDIOATE | A,B,C,D | 1JDF | 0.74 | |
ICA | ISOCITRATE CALCIUM COMPLEX | A | 1AI2 | 0.75 |