Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03034026
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 |
IPM | 3-ISOPROPYLMALIC ACID | A,B | 1A05 | 0.71 | |
IPM | 3-ISOPROPYLMALIC ACID | A | 1HJ6 | 0.71 | |
3HL | (3S)-3-HYDROXYBUTANOIC ACID | A | 2ECQ | 0.72 | |
3HL | (3S)-3-HYDROXYBUTANOIC ACID | A,B,C,D | 3EEW | 0.72 | |
3LR | 3,6-dideoxy-L-arabino-hexonic acid | A,B | 3CXO | 0.74 | |
CS2 | D-MANNONIC ACID | A,B,C,D | 2QJM | 0.73 | |
CS2 | D-MANNONIC ACID | A,B | 3DBN | 0.73 | |
ICT | ISOCITRIC ACID | A | 1IDE | 0.71 | |
ICT | ISOCITRIC ACID | A,B | 2UXR | 0.71 | |
ICT | ISOCITRIC ACID | A,B | 1XKD | 0.71 | |
ICT | ISOCITRIC ACID | A | 8ICD | 0.71 | |
ICT | ISOCITRIC ACID | A,B,D | 1XG4 | 0.71 | |
ICT | ISOCITRIC ACID | A | 1CW7 | 0.71 | |
ICT | ISOCITRIC ACID | A | 1GRO | 0.71 | |
ICT | ISOCITRIC ACID | A | 1W8G | 0.71 | |
ICT | ISOCITRIC ACID | A | 5ICD | 0.71 | |
ICT | ISOCITRIC ACID | A,B | 1LWD | 0.71 | |
ICT | ISOCITRIC ACID | A,B,C,D | 1ITW | 0.71 | |
ICT | ISOCITRIC ACID | A,B,C,D | 1T0L | 0.71 | |
ICT | ISOCITRIC ACID | A | 1PB1 | 0.71 | |
ICT | ISOCITRIC ACID | A | 1GRP | 0.71 | |
ICT | ISOCITRIC ACID | A | 1CW1 | 0.71 | |
ICT | ISOCITRIC ACID | A,B,C,D,E,F | 2QFW | 0.71 | |
ICT | ISOCITRIC ACID | A | 1B0J | 0.71 | |
ICT | ISOCITRIC ACID | A | 1W7F | 0.71 | |
ICT | ISOCITRIC ACID | A | 7ACN | 0.71 | |
ICT | ISOCITRIC ACID | A | 1C97 | 0.71 | |
ICT | ISOCITRIC ACID | A | 1P8F | 0.71 | |
ICT | ISOCITRIC ACID | A | 2CSG | 0.71 | |
ICA | ISOCITRATE CALCIUM COMPLEX | A | 1AI2 | 0.71 | |
DGY | (2R)-2,3-DIHYDROXYPROPANOIC ACID | A,B,C,D | 2GCG | 0.81 | |
DGY | (2R)-2,3-DIHYDROXYPROPANOIC ACID | A,B | 2BO6 | 0.81 | |
DEZ | 4-PHOSPHO-D-ERYTHRONATE | A,B,C,D,E | 2BET | 0.78 | |
GCO | GLUCONIC ACID | B,C,D | 1BGG | 0.73 | |
GCO | GLUCONIC ACID | A,B | 1XLF | 0.73 | |
3PY | 3-HYDROXYPYRUVIC ACID | A,B,C,D | 1HL2 | 0.71 | |
3PY | 3-HYDROXYPYRUVIC ACID | A,B | 1O5X | 0.71 | |
3PY | 3-HYDROXYPYRUVIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1NFV | 0.71 | |
3PY | 3-HYDROXYPYRUVIC ACID | A,B,C,D | 1FDY | 0.71 | |
DXG | 4-DEOXYGLUCARATE | A,B,C,D | 1ECQ | 0.73 | |
GLR | 2,3-DIHYDROXY-5-OXO-HEXANEDIOATE | A,B,C,D | 1EC8 | 0.7 | |
GLR | 2,3-DIHYDROXY-5-OXO-HEXANEDIOATE | A,B,C,D | 1JDF | 0.7 | |
GKR | D-GLUCARATE | A | 3CXT | 0.71 | |
GKR | D-GLUCARATE | A,B | 1JCT | 0.71 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | A,B,C,D | 2VK8 | 0.78 | |
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 | 0.78 | |
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 | 0.78 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | A,C,E | 2VOJ | 0.78 | |
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 | 0.78 | |
2OP | (2S)-2-HYDROXYPROPANOIC ACID | A | 1W9N | 0.78 | |
DER | D-4-PHOSPHOERYTHRONIC ACID | A,B,C,D | 1LK7 | 0.78 | |
DER | D-4-PHOSPHOERYTHRONIC ACID | A,B | 2CXO | 0.78 | |
DMV | 2,3-DIHYDROXY-VALERIANIC ACID | A,B,C,D | 1QMG | 0.72 | |
1N5 | (2R,4S)-2,4,7-trihydroxyheptanoic acid | A,B | 3CXO | 0.78 | |
DMR | 2-HYDROXY-SUCCINIC ACID | A,B | 2YZO | 0.92 | |
DMR | 2-HYDROXY-SUCCINIC ACID | A | 4CSC | 0.92 | |
DMR | 2-HYDROXY-SUCCINIC ACID | H,L | 1C1E | 0.92 | |
DMR | 2-HYDROXY-SUCCINIC ACID | A | 2CSC | 0.92 | |
DMR | 2-HYDROXY-SUCCINIC ACID | A | 2AR9 | 0.92 | |
1LU | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | E,I | 6TMN | 0.7 | |
1LU | 4-METHYL-PENTANOIC ACID-2-OXYL GROUP | I | 1DS2 | 0.7 | |
ITM | ISOCITRIC ACID-MAGNESIUM COMPLEX | A | 1AI3 | 0.71 |