Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02825302
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 |
1LU![]() | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | E,I | 6TMN | 0.95 | ![]() |
1LU![]() | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | I | 1DS2 | 0.95 | ![]() |
VAD![]() | DEAMINOHYDROXYVALINE | C | 1CWO | 0.86 | ![]() |
COI![]() | 2-OXO-4-METHYLPENTANOIC ACID | A,B | 1QS0 | 0.79 | ![]() |
COI![]() | 2-OXO-4-METHYLPENTANOIC ACID | A,C | 1UMD | 0.79 | ![]() |
COI![]() | 2-OXO-4-METHYLPENTANOIC ACID | A | 1DXY | 0.79 | ![]() |
COI![]() | 2-OXO-4-METHYLPENTANOIC ACID | A,B | 2HDK | 0.79 | ![]() |
COI![]() | 2-OXO-4-METHYLPENTANOIC ACID | A | 1HJF | 0.79 | ![]() |
DMV![]() | 2,3-DIHYDROXY-VALERIANIC ACID | A,B,C,D | 1QMG | 0.79 | ![]() |
IPM![]() | 3-ISOPROPYLMALIC ACID | A,B | 1A05 | 0.78 | ![]() |
IPM![]() | 3-ISOPROPYLMALIC ACID | A | 1HJ6 | 0.78 | ![]() |
TFB![]() | TETRAHYDROFURAN-2-CARBOXYLIC ACID | A | 1TIW | 0.75 | ![]() |
TFB![]() | TETRAHYDROFURAN-2-CARBOXYLIC ACID | A | 3E2R | 0.75 | ![]() |
TFB![]() | TETRAHYDROFURAN-2-CARBOXYLIC ACID | A | 1KB0 | 0.75 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A,B,C | 1I1M | 0.74 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A,B,C | 2EIY | 0.74 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A | 2ECO | 0.74 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A,C,D | 1UMC | 0.74 | ![]() |
4MV![]() | 4-METHYL VALERIC ACID | A,B | 2COG | 0.74 | ![]() |
PAF![]() | PANTOATE | A,B | 2OFP | 0.73 | ![]() |
PAF![]() | PANTOATE | A,B | 1N2E | 0.73 | ![]() |
PAF![]() | PANTOATE | A,B | 1N2B | 0.73 | ![]() |
PAF![]() | PANTOATE | A,B | 1N2J | 0.73 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1IDE | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A,B | 2UXR | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A,B | 1XKD | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 8ICD | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A,B,D | 1XG4 | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1CW7 | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1GRO | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1W8G | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 5ICD | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A,B | 1LWD | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A,B,C,D | 1ITW | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A,B,C,D | 1T0L | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1PB1 | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1GRP | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1CW1 | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A,B,C,D,E,F | 2QFW | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1B0J | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1W7F | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 7ACN | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1C97 | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 1P8F | 0.72 | ![]() |
ICT![]() | ISOCITRIC ACID | A | 2CSG | 0.72 | ![]() |
HOC![]() | (2S)-2-HYDROXYOCTANOIC ACID | A | 2A85 | 0.71 | ![]() |