Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813249
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 |
OXS![]() | 2-OXALOSUCCINIC ACID | A | 1IDC | 0.83 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E,F, G,H | 1M1N | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E,G, I,J,K,L,N,P | 1M1Y | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E,F, G,H | 1G21 | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D | 1QGU | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | B,D | 1MIO | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2AFI | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D | 1QH8 | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1M34 | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D | 1FP4 | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C | 2MIN | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E,G | 1G20 | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E,F, G,H | 1N2C | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E,F, G,H | 2AFK | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D | 1QH1 | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D | 3MIN | 0.77 | ![]() |
HCA![]() | 3-HYDROXY-3-CARBOXY-ADIPIC ACID | A,B,C,D,E | 2AFH | 0.77 | ![]() |
HCT![]() | (2R)-butane-1,2,4-tricarboxylic acid | A,B,C | 3DP8 | 0.76 | ![]() |
HCT![]() | (2R)-butane-1,2,4-tricarboxylic acid | A,B,C | 3E3K | 0.76 | ![]() |
MIC![]() | ALPHA-METHYLISOCITRIC ACID | A | 1AMI | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3C2H | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3D71 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BWT | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1O9C | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2P4Q | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3D8Z | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,D,M,N,P | 2B76 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2FUF | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 1V9A | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2CMV | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2G4U | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1C96 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BWY | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3B4Y | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BH3 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F, G,H | 3HZN | 0.71 | ![]() |
FLC![]() | CITRATE ANION | B | 1C5Z | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3D6Q | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2B5W | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BWW | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3EXL | 0.71 | ![]() |
FLC![]() | CITRATE ANION | E,G | 2OOY | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BN7 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2QY2 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3H95 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1B0K | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2PLX | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C | 2O66 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2OK8 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2VJE | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3EXJ | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 3G8W | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2Q7B | 0.71 | ![]() |
FLC![]() | CITRATE ANION | B | 1C5X | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1HH8 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3FIR | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2J8T | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2VZY | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2ZDW | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1N5I | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BWU | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3F1S | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3EB9 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2J9T | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2ZDF | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1M27 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2EKN | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2H4V | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 1R0E | 0.71 | ![]() |
FLC![]() | CITRATE ANION | B | 2IWT | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3D8Y | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BHA | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2D4V | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3D6N | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BHD | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,D,E | 2HRT | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3GBE | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2J80 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BHC | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2VJF | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1C5R | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F, G,H,I,J,K,L | 1XK4 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2JFV | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1PO0 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2GIF | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1ZB7 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1S69 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2HXW | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F, G,H,I,J | 1P0Z | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2BJK | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2EV6 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2GON | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2ZDD | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F, G,H | 1W7R | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3CRV | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,D | 2R40 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2HHP | 0.71 | ![]() |
FLC![]() | CITRATE ANION | P | 2OYE | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 2IY6 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 3BE8 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1O9E | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,D | 1I7A | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1S6A | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,C,E,G,I,K, M,O | 3BLW | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2P6W | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3HOI | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F, G,H | 3EUA | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F | 2FT3 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2P2W | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 1B0M | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 3CNV | 0.71 | ![]() |
FLC![]() | CITRATE ANION | B | 1C5Y | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C | 2QK9 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | B | 2W04 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2ZDE | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F, G,H | 3BLV | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 1YTA | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2BHB | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F, G,H,I,J,K,L | 1R0B | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D,E,F | 2BO4 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B,C,D | 2BP1 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 1PO3 | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A,B | 1T6N | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3D7B | 0.71 | ![]() |
FLC![]() | CITRATE ANION | B | 1C5W | 0.71 | ![]() |
FLC![]() | CITRATE ANION | F,J,L | 2GUZ | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3GBD | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 2JHS | 0.71 | ![]() |
FLC![]() | CITRATE ANION | A | 3BFP | 0.71 | ![]() |
FLC![]() | CITRATE ANION | B | 2BL8 | 0.71 | ![]() |
ITM![]() | ISOCITRIC ACID-MAGNESIUM COMPLEX | A | 1AI3 | 0.7 | ![]() |
ICA![]() | ISOCITRATE CALCIUM COMPLEX | A | 1AI2 | 0.7 | ![]() |