Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00712647
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 |
O12 | N~5~-dodecanoyl-L-ornithine | A,B,C,D,E,F, G,H,I,J,K,L | 3CAY | 0.74 | |
O12 | N~5~-dodecanoyl-L-ornithine | A,B,C,D,E,F, G,H,I,J,K,L | 3CBA | 0.74 | |
C6L | N-hexanoyl-L-homoserine | A | 3DHA | 0.71 | |
C6L | N-hexanoyl-L-homoserine | A | 3DHB | 0.71 | |
IGN | {[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)- 1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID | A | 1K1O | 0.72 | |
IGN | {[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)- 1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID | H,I | 1K21 | 0.72 | |
LAE | 3-OXO-OCTANOIC ACID (2-OXO-TETRAHYDRO- FURAN-3-YL)-AMIDE | A,B,C,D | 1L3L | 0.71 | |
LAE | 3-OXO-OCTANOIC ACID (2-OXO-TETRAHYDRO- FURAN-3-YL)-AMIDE | A,B | 2Q0O | 0.71 | |
140 | N-PALMITOYLGLYCINE | A,B | 1JPZ | 0.79 | |
140 | N-PALMITOYLGLYCINE | A,B | 1ZOA | 0.79 | |
140 | N-PALMITOYLGLYCINE | A,B | 3CBD | 0.79 | |
CYK | N-hexanoyl-L-homocysteine | A | 3DHC | 0.72 | |
OIC | OCTAHYDROINDOLE-2-CARBOXYLIC ACID | B,C | 3BV9 | 0.7 | |
OIC | OCTAHYDROINDOLE-2-CARBOXYLIC ACID | A | 1BDK | 0.7 | |
MCP | 2-CARBOXY-4-METHYLPIPERIDINE | H | 1ETR | 0.74 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D | 1D5Z | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | H,I | 5GDS | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | H,P | 2A2X | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D,H | 2FEQ | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | H,P | 2ANK | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,C,D | 3DPP | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A | 1EB1 | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D,H | 1NZQ | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | I | 1HBT | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D | 1D6E | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,B | 1B3H | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D,H | 2FES | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | C,D,E,G,H | 3DPQ | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | I | 1THS | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | I | 1QUR | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,B,C,D | 3DPO | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | H,I | 4THN | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,D | 1D5M | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D,H | 1O0D | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1YWH | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A | 1XRZ | 0.72 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D | 1D5X | 0.72 | |
AR9 | (2R,4S)-N-butyl-4-[(2S,5S,7R)-2,7- dimethyl-3,15-dioxo-1,4-diazacyclopentadecan- 5-yl]-4-hydroxy-2-methylbutanamide | A,B,C | 3DV1 | 0.71 | |
BUJ | (3R)-3-(hexadecanoylamino)-4-(trimethylammonio)butanoate | A,B | 2RCU | 0.72 | |
DLS | DI-ACETYL-LYSINE | A,B,C,D,E,F | 1FVM | 0.74 | |
OHN | N-3-OXO-DODECANOYL-L-HOMOSERINE LACTONE | E,F,G,H | 2UV0 | 0.72 | |
EPM | N-PALMITOYL-L-METHIONINE | A,B | 1ZO9 | 0.74 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2B4D | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2OD9 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,C,P,Q | 2DVR | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,C,P,Q | 2DVS | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,C,P,Q | 2DVQ | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,C,D | 2OT7 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2B5G | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 2GIV | 0.72 | |
ALY | N(6)-ACETYLLYSINE | B | 2RNY | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 1JSP | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,I,L | 2V5W | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,D | 3D4B | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,C,D | 2OQ6 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2R0Y | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 3CZ7 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 1JM4 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2H4H | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2J6V | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2R10 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 1YC5 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,C,D | 2OX0 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2H2G | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,D | 2H4F | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 2OU2 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 1S5P | 0.72 | |
ALY | N(6)-ACETYLLYSINE | B | 2RNW | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 3D35 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2OD2 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 2ZFN | 0.72 | |
ALY | N(6)-ACETYLLYSINE | C,D | 2C1J | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2QQG | 0.72 | |
ALY | N(6)-ACETYLLYSINE | B | 2RNX | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 1MA3 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2H2H | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 2I2Z | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2OD7 | 0.72 | |
ALY | N(6)-ACETYLLYSINE | P | 1E6I | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 1SZC | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,C,D,I,J, K,L | 3EWF | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2H2D | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 1Q1A | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 1SZD | 0.72 | |
ALY | N(6)-ACETYLLYSINE | Q,R | 2E3K | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A | 2OZU | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B | 2QQF | 0.72 | |
ALY | N(6)-ACETYLLYSINE | A,B,C | 2R0V | 0.72 | |
MNL | 4,N-DIMETHYLNORLEUCINE | C | 1CWC | 0.76 | |
CHG | CYCLOHEXYL-GLYCINE | 2,3,4 | 8KME | 0.7 | |
CHG | CYCLOHEXYL-GLYCINE | H,I | 4THN | 0.7 | |
CHG | CYCLOHEXYL-GLYCINE | H,I,J | 7KME | 0.7 | |
CHG | CYCLOHEXYL-GLYCINE | H,I | 5GDS | 0.7 | |
HTF | N-(2-OXOTETRAHYDROFURAN-3-YL)OCTANAMIDE | A | 2AVX | 0.76 | |
BEQ | N-(CARBOXYMETHYL)-N,N-DIMETHYL- 3-[(1-OXODODECYL)AMINO]-1-PROPANAMINIUM INNER SALT | A,B,C,D | 1YBK | 0.78 | |
277 | N-(TRANS-4-{(1S,2S)-2-AMINO-3-[(3S)- 3-FLUOROPYRROLIDIN-1-YL]-1-METHYL- 3-OXOPROPYL}CYCLOHEXYL)-N-METHYLACETAMIDE | A,B | 2OPH | 0.75 |