Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03444646
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 |
ITM | ISOCITRIC ACID-MAGNESIUM COMPLEX | A | 1AI3 | 0.74 | |
LAC | LACTIC ACID | A | 2FLT | 0.73 | |
LAC | LACTIC ACID | A | 2IMP | 0.73 | |
LAC | LACTIC ACID | A | 1C0Q | 0.73 | |
LAC | LACTIC ACID | E,I,P | 1P11 | 0.73 | |
LAC | LACTIC ACID | A,B | 2NLI | 0.73 | |
LAC | LACTIC ACID | A,B,C,D | 2PI1 | 0.73 | |
LAC | LACTIC ACID | A | 1C0R | 0.73 | |
LAC | LACTIC ACID | A | 1UHD | 0.73 | |
LAC | LACTIC ACID | C,D | 1AXD | 0.73 | |
LAC | LACTIC ACID | A | 1QH9 | 0.73 | |
LAC | LACTIC ACID | A | 2P1E | 0.73 | |
LAC | LACTIC ACID | A | 1K87 | 0.73 | |
LAC | LACTIC ACID | E,I | 1P12 | 0.73 | |
LAC | LACTIC ACID | A | 1W3Q | 0.73 | |
LAC | LACTIC ACID | A | 1C0K | 0.73 | |
LAC | LACTIC ACID | A,B | 2FN7 | 0.73 | |
LAC | LACTIC ACID | A | 1TJ1 | 0.73 | |
LAC | LACTIC ACID | A | 1TJ0 | 0.73 | |
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 | |
VAD | DEAMINOHYDROXYVALINE | C | 1CWO | 0.9 | |
PAF | PANTOATE | A,B | 2OFP | 0.76 | |
PAF | PANTOATE | A,B | 1N2E | 0.76 | |
PAF | PANTOATE | A,B | 1N2B | 0.76 | |
PAF | PANTOATE | A,B | 1N2J | 0.76 | |
4MV | 4-METHYL VALERIC ACID | A,B,C | 1I1M | 0.73 | |
4MV | 4-METHYL VALERIC ACID | A,B,C | 2EIY | 0.73 | |
4MV | 4-METHYL VALERIC ACID | A | 2ECO | 0.73 | |
4MV | 4-METHYL VALERIC ACID | A,C,D | 1UMC | 0.73 | |
4MV | 4-METHYL VALERIC ACID | A,B | 2COG | 0.73 | |
MEV | (R)-MEVALONATE | A,B | 1QAY | 0.72 | |
MEV | (R)-MEVALONATE | A | 2HFU | 0.72 | |
MEV | (R)-MEVALONATE | A,B | 1R31 | 0.72 | |
DMV | 2,3-DIHYDROXY-VALERIANIC ACID | A,B,C,D | 1QMG | 0.87 | |
IPM | 3-ISOPROPYLMALIC ACID | A,B | 1A05 | 0.82 | |
IPM | 3-ISOPROPYLMALIC ACID | A | 1HJ6 | 0.82 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | A,B,C,D | 2VK8 | 0.73 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | 0,1,3,4,9,A, B,C,H,J,K,L, M,N,O,Q,R,S, T,U,Y,Z | 1VQ7 | 0.73 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | 0,1,3,4,9,A, B,C,H,J,K,L, M,N,O,Q,R,S, T,U,Y,Z | 1VQ4 | 0.73 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | A,C,E | 2VOJ | 0.73 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | 0,1,2,3,4,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ5 | 0.73 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | A | 1W9N | 0.73 | |
ICT | ISOCITRIC ACID | A | 1IDE | 0.78 | |
ICT | ISOCITRIC ACID | A,B | 2UXR | 0.78 | |
ICT | ISOCITRIC ACID | A,B | 1XKD | 0.78 | |
ICT | ISOCITRIC ACID | A | 8ICD | 0.78 | |
ICT | ISOCITRIC ACID | A,B,D | 1XG4 | 0.78 | |
ICT | ISOCITRIC ACID | A | 1CW7 | 0.78 | |
ICT | ISOCITRIC ACID | A | 1GRO | 0.78 | |
ICT | ISOCITRIC ACID | A | 1W8G | 0.78 | |
ICT | ISOCITRIC ACID | A | 5ICD | 0.78 | |
ICT | ISOCITRIC ACID | A,B | 1LWD | 0.78 | |
ICT | ISOCITRIC ACID | A,B,C,D | 1ITW | 0.78 | |
ICT | ISOCITRIC ACID | A,B,C,D | 1T0L | 0.78 | |
ICT | ISOCITRIC ACID | A | 1PB1 | 0.78 | |
ICT | ISOCITRIC ACID | A | 1GRP | 0.78 | |
ICT | ISOCITRIC ACID | A | 1CW1 | 0.78 | |
ICT | ISOCITRIC ACID | A,B,C,D,E,F | 2QFW | 0.78 | |
ICT | ISOCITRIC ACID | A | 1B0J | 0.78 | |
ICT | ISOCITRIC ACID | A | 1W7F | 0.78 | |
ICT | ISOCITRIC ACID | A | 7ACN | 0.78 | |
ICT | ISOCITRIC ACID | A | 1C97 | 0.78 | |
ICT | ISOCITRIC ACID | A | 1P8F | 0.78 | |
ICT | ISOCITRIC ACID | A | 2CSG | 0.78 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B | 1KTA | 0.73 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A | 1HJG | 0.73 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B | 1SR9 | 0.73 | |
KIV | 3-METHYL-2-OXOBUTANOIC ACID | A,B,C,D,E | 1O68 | 0.73 | |
ICA | ISOCITRATE CALCIUM COMPLEX | A | 1AI2 | 0.74 | |
TFB | TETRAHYDROFURAN-2-CARBOXYLIC ACID | A | 1TIW | 0.71 | |
TFB | TETRAHYDROFURAN-2-CARBOXYLIC ACID | A | 3E2R | 0.71 | |
TFB | TETRAHYDROFURAN-2-CARBOXYLIC ACID | A | 1KB0 | 0.71 | |
1N5 | (2R,4S)-2,4,7-trihydroxyheptanoic acid | A,B | 3CXO | 0.7 | |
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 | |
HOC | (2S)-2-HYDROXYOCTANOIC ACID | A | 2A85 | 0.73 | |
3LR | 3,6-dideoxy-L-arabino-hexonic acid | A,B | 3CXO | 0.71 |