Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03446571
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 |
LML | ISOBUTYL MALONIC ACID | A | 1BFW | 0.83 | |
DMV | 2,3-DIHYDROXY-VALERIANIC ACID | A,B,C,D | 1QMG | 0.8 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A,B | 1QS0 | 0.76 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A,C | 1UMD | 0.76 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A | 1DXY | 0.76 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A,B | 2HDK | 0.76 | |
COI | 2-OXO-4-METHYLPENTANOIC ACID | A | 1HJF | 0.76 | |
HLU | BETA-HYDROXYLEUCINE | A | 1ROV | 0.74 | |
HIU | (2R)-3-HYDROXY-2-METHYLPROPANOIC ACID | A | 3BPT | 0.77 | |
IPM | 3-ISOPROPYLMALIC ACID | A,B | 1A05 | 0.8 | |
IPM | 3-ISOPROPYLMALIC ACID | A | 1HJ6 | 0.8 | |
GVM | (3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACID | A,B | 2UW1 | 0.81 | |
RB3 | (1R)-3-{[(1R)-3-METHOXY-1-METHYL- 3-OXOPROPYL]OXY}-1-METHYL-3-OXOPROPYL (3R)- 3-HYDROXYBUTANOATE | A | 2D81 | 0.73 | |
SHO | 5-HYDROXYLAEVULINIC ACID | A | 1W31 | 0.71 | |
1LU | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | E,I | 6TMN | 0.84 | |
1LU | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | I | 1DS2 | 0.84 | |
VAD | DEAMINOHYDROXYVALINE | C | 1CWO | 0.74 | |
HXD | (3R)-3-HYDROXYDODECANOIC ACID | A | 2DDH | 0.73 | |
4MV | 4-METHYL VALERIC ACID | A,B,C | 1I1M | 0.79 | |
4MV | 4-METHYL VALERIC ACID | A,B,C | 2EIY | 0.79 | |
4MV | 4-METHYL VALERIC ACID | A | 2ECO | 0.79 | |
4MV | 4-METHYL VALERIC ACID | A,C,D | 1UMC | 0.79 | |
4MV | 4-METHYL VALERIC ACID | A,B | 2COG | 0.79 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1QFF | 0.73 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1QJQ | 0.73 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A,B | 2GRX | 0.73 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1QFG | 0.73 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1QKC | 0.73 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A | 1FI1 | 0.73 | |
FTT | 3-HYDROXY-TETRADECANOIC ACID | A,B,C,D | 3FXI | 0.73 | |
MEV | (R)-MEVALONATE | A,B | 1QAY | 0.82 | |
MEV | (R)-MEVALONATE | A | 2HFU | 0.82 | |
MEV | (R)-MEVALONATE | A,B | 1R31 | 0.82 | |
3HG | 3-HYDROXYPENTANEDIOIC ACID | A,B,C,D,E,F | 2CW6 | 0.79 | |
3HL | (3S)-3-HYDROXYBUTANOIC ACID | A | 2ECQ | 0.82 | |
3HL | (3S)-3-HYDROXYBUTANOIC ACID | A,B,C,D | 3EEW | 0.82 | |
ICT | ISOCITRIC ACID | A | 1IDE | 0.73 | |
ICT | ISOCITRIC ACID | A,B | 2UXR | 0.73 | |
ICT | ISOCITRIC ACID | A,B | 1XKD | 0.73 | |
ICT | ISOCITRIC ACID | A | 8ICD | 0.73 | |
ICT | ISOCITRIC ACID | A,B,D | 1XG4 | 0.73 | |
ICT | ISOCITRIC ACID | A | 1CW7 | 0.73 | |
ICT | ISOCITRIC ACID | A | 1GRO | 0.73 | |
ICT | ISOCITRIC ACID | A | 1W8G | 0.73 | |
ICT | ISOCITRIC ACID | A | 5ICD | 0.73 | |
ICT | ISOCITRIC ACID | A,B | 1LWD | 0.73 | |
ICT | ISOCITRIC ACID | A,B,C,D | 1ITW | 0.73 | |
ICT | ISOCITRIC ACID | A,B,C,D | 1T0L | 0.73 | |
ICT | ISOCITRIC ACID | A | 1PB1 | 0.73 | |
ICT | ISOCITRIC ACID | A | 1GRP | 0.73 | |
ICT | ISOCITRIC ACID | A | 1CW1 | 0.73 | |
ICT | ISOCITRIC ACID | A,B,C,D,E,F | 2QFW | 0.73 | |
ICT | ISOCITRIC ACID | A | 1B0J | 0.73 | |
ICT | ISOCITRIC ACID | A | 1W7F | 0.73 | |
ICT | ISOCITRIC ACID | A | 7ACN | 0.73 | |
ICT | ISOCITRIC ACID | A | 1C97 | 0.73 | |
ICT | ISOCITRIC ACID | A | 1P8F | 0.73 | |
ICT | ISOCITRIC ACID | A | 2CSG | 0.73 | |
MAH | 3-HYDROXY-3-METHYL-GLUTARIC ACID | A,B,C,D | 1DQA | 0.73 | |
MAH | 3-HYDROXY-3-METHYL-GLUTARIC ACID | A,B,C,D | 1DQ8 | 0.73 | |
2PP | 2-PROPYL-PENTANOIC ACID | P | 1DIT | 0.7 |