Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02475872
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 |
CR6![]() | 1-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO- 2-HEPTULOPYRANOSONAMIDE | A | 1P4H | 0.71 | ![]() |
CR6![]() | 1-DEOXY-1-ACETYLAMINO-BETA-D-GLUCO- 2-HEPTULOPYRANOSONAMIDE | A | 1FU8 | 0.71 | ![]() |
AMU![]() | BETA-N-ACETYLMURAMIC ACID | A,B,C,D | 2APH | 0.74 | ![]() |
AMU![]() | BETA-N-ACETYLMURAMIC ACID | A,P | 1TWQ | 0.74 | ![]() |
AMU![]() | BETA-N-ACETYLMURAMIC ACID | A | 1D0K | 0.74 | ![]() |
AMU![]() | BETA-N-ACETYLMURAMIC ACID | S | 9LYZ | 0.74 | ![]() |
AMU![]() | BETA-N-ACETYLMURAMIC ACID | E,S | 148L | 0.74 | ![]() |
AMU![]() | BETA-N-ACETYLMURAMIC ACID | D,K | 3CYQ | 0.74 | ![]() |
AMU![]() | BETA-N-ACETYLMURAMIC ACID | U | 2AIZ | 0.74 | ![]() |
AMV![]() | METHYL 2-(ACETYLAMINO)-3-O-[(1R)- 1-CARBOXYETHYL]-2-DEOXY-BETA-D- GLUCOPYRANOSIDE | A | 2J8G | 0.72 | ![]() |
AMV![]() | METHYL 2-(ACETYLAMINO)-3-O-[(1R)- 1-CARBOXYETHYL]-2-DEOXY-BETA-D- GLUCOPYRANOSIDE | A | 2J8F | 0.72 | ![]() |
FSI![]() | 5-(ACETYLAMINO)-2,6-ANHYDRO-3,5- DIDEOXY-3-FLUORONONONIC ACID | A | 2AH2 | 0.75 | ![]() |
FSI![]() | 5-(ACETYLAMINO)-2,6-ANHYDRO-3,5- DIDEOXY-3-FLUORONONONIC ACID | A | 2FHR | 0.75 | ![]() |
FSI![]() | 5-(ACETYLAMINO)-2,6-ANHYDRO-3,5- DIDEOXY-3-FLUORONONONIC ACID | A | 2A75 | 0.75 | ![]() |
FSI![]() | 5-(ACETYLAMINO)-2,6-ANHYDRO-3,5- DIDEOXY-3-FLUORONONONIC ACID | A,B | 2VK7 | 0.75 | ![]() |
7GP![]() | ETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATE | A | 2F3S | 0.75 | ![]() |
AMN![]() | 9-DEOXY-9-AMINO-2-O-METHYL-5-N- ACETYL-ALPHA-D-NEURAMINIC ACID | A,B,C,D,E,F | 1HGJ | 0.73 | ![]() |
042![]() | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-THREONYL-L-ISOLEUCINE | A | 2DC7 | 0.73 | ![]() |
233![]() | [5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL- TETRAHYDRO-PYRAN-2-YLCARBAMOYL)- PENTYL]-CARBAMIC ACID METHYL ESTER | D,E,F,G,H | 1MD2 | 0.71 | ![]() |
GSL![]() | (2S,3R)-3-HYDROXY-2-(TETRADECANOYLAMINO)OCTADECYL ALPHA- D-GALACTOPYRANOSIDURONIC ACID | A | 2FIK | 0.79 | ![]() |
76V![]() | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCYL-L-ISOLEUCINE | A | 2DCB | 0.71 | ![]() |
6GP![]() | METHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATE | A | 2F3Q | 0.74 | ![]() |
DH9![]() | (2S,3S,5S)-5-[(N-FORMYL-L-LEUCYL)OXY]- 2-HEXYL-3-HYDROXYHEXADECANOIC ACID | A,B | 2PX6 | 0.73 | ![]() |
4GP![]() | N-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACID | A | 2F3P | 0.71 | ![]() |
ANA![]() | 4-O-ACETYL-ALPHA-2-OMETHYL-5-N- ACETYL-ALPHA-D-NEURAMINIC ACID | A,B,C,D,E,F | 1HGI | 0.74 | ![]() |
ABW![]() | 5-[1-(ACETYLAMINO)-3-METHYLBUTYL]- 2,5-ANHYDRO-3,4-DIDEOXY-4-(METHOXYCARBONYL)PENTONIC ACID | A | 1XOG | 0.74 | ![]() |
75V![]() | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCYL-L-ALANINE | A | 2DCA | 0.7 | ![]() |
HMN![]() | 2,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDO NONANOIC ACID | A,B,C,D | 1F73 | 0.73 | ![]() |
CRA![]() | 1-DEOXY-1-METHOXYCARBAMIDO-BETA- D-GLUCO-2-HEPTULOPYRANOSONAMIDE | A | 1FS4 | 0.73 | ![]() |
CRA![]() | 1-DEOXY-1-METHOXYCARBAMIDO-BETA- D-GLUCO-2-HEPTULOPYRANOSONAMIDE | A | 1B4D | 0.73 | ![]() |
GDL![]() | 2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE | A,B | 1UR9 | 0.8 | ![]() |
GDL![]() | 2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE | A,B,C,D,E,F | 1O7A | 0.8 | ![]() |
GDL![]() | 2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5- LACTONE | A,B | 1UR8 | 0.8 | ![]() |
59A![]() | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCINE | A | 2DC8 | 0.74 | ![]() |