Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00468423
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 |
GTY![]() | L-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINE | A | 1U88 | 0.72 | ![]() |
LNT![]() | N-[(2S)-2-amino-1,1-dihydroxy-4- methylpentyl]-L-threonine | A,B,C | 3B80 | 0.74 | ![]() |
LNT![]() | N-[(2S)-2-amino-1,1-dihydroxy-4- methylpentyl]-L-threonine | A,B,C | 3B7V | 0.74 | ![]() |
TMD![]() | (6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N- DIMETHYL-THREONINE | C | 1CWK | 0.73 | ![]() |
VAZ![]() | N^6^-{(1R)-2-{[(1S,2R)-1-carboxy- 2-hydroxy-2-(methylsulfanyl)ethyl]oxy}- 1-[(oxidosulfanyl)methyl]-2-oxoethyl}- 6-oxo-L-lysine | A | 2VBB | 0.71 | ![]() |
HCG![]() | DELTA-(L-ALPHA-AMINOADIPOYL)-L- CYSTEINYL-GLYCINE | A | 1W03 | 0.7 | ![]() |
HCG![]() | DELTA-(L-ALPHA-AMINOADIPOYL)-L- CYSTEINYL-GLYCINE | A | 1W04 | 0.7 | ![]() |
HJ3![]() | (2R,4S)-2-[(1R)-1-{[(6S)-6-amino- 6-carboxyhexanoyl]amino}-2-oxoethyl]- 5,5-dimethyl-1,3-thiazolidine-4- carboxylic acid | A | 3BEB | 0.76 | ![]() |
EPM![]() | N-PALMITOYL-L-METHIONINE | A,B | 1ZO9 | 0.76 | ![]() |
ACV![]() | L-D-(A-AMINOADIPOYL)-L-CYSTEINYL- D-VALINE | A | 2BJS | 0.75 | ![]() |
ACV![]() | L-D-(A-AMINOADIPOYL)-L-CYSTEINYL- D-VALINE | A | 1QJE | 0.75 | ![]() |
ACV![]() | L-D-(A-AMINOADIPOYL)-L-CYSTEINYL- D-VALINE | A | 1BK0 | 0.75 | ![]() |
ACV![]() | L-D-(A-AMINOADIPOYL)-L-CYSTEINYL- D-VALINE | A | 1BLZ | 0.75 | ![]() |
097![]() | (2S,3R)-N~4~-[(1S)-2,2-dimethyl- 1-(methylcarbamoyl)propyl]-N~1~,2- dihydroxy-3-(2-methylpropyl)butanediamide | A,B | 3HY7 | 0.7 | ![]() |
097![]() | (2S,3R)-N~4~-[(1S)-2,2-dimethyl- 1-(methylcarbamoyl)propyl]-N~1~,2- dihydroxy-3-(2-methylpropyl)butanediamide | A,B | 2JIH | 0.7 | ![]() |
097![]() | (2S,3R)-N~4~-[(1S)-2,2-dimethyl- 1-(methylcarbamoyl)propyl]-N~1~,2- dihydroxy-3-(2-methylpropyl)butanediamide | A | 1R55 | 0.7 | ![]() |
LAS![]() | N-acetyl-S-({(2R,3S,4R)-3-hydroxy- 2-[(1S)-1-hydroxy-2-methylpropyl]- 4-methyl-5-oxopyrrolidin-2-yl}carbonyl)cysteine | A,B | 3DPM | 0.81 | ![]() |
MDZ![]() | N~6~-METHYL-6-OXO-L-LYSINE - 2- [(3-MERCAPTOBUTANOYL)OXY]-3-METHYLBUTANOIC ACID | A | 1W3V | 0.7 | ![]() |
U17![]() | METHYL N-[(2S,3R)-3-AMINO-2-HYDROXYHEPTANOYL]- L-SERYL-L-LEUCINATE | A | 2GGB | 0.77 | ![]() |
DWZ![]() | (2S,3R,4S)-4-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin- 3-yl]sulfanyl}-2-[(1S,2R)-1-formyl- 2-hydroxypropyl]-3-methyl-3,4-dihydro- 2H-pyrrole-5-carboxylic acid | A | 3DWZ | 0.7 | ![]() |
AXQ![]() | {(E)-(3R,6S,9R)-3-[(1S,3R)-3-((S)- 1 -BUTYLCARBAMOYL-2-METHYL-PROPYLCARB AMOYL)- 1-HYDROXY-BUTYL]-6-METHYL-5, 8- DIOXO-1,11-DITHIA-4,7-DIAZA-CYCLO PENTADEC- 13-EN-9-YL}-CARBAMIC ACID TERT- BUTYL ESTER | A,B,C | 2F3E | 0.73 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1PPP | 0.76 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1PE6 | 0.76 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1ITO | 0.76 | ![]() |
5FE![]() | 5,5,5-TRIFLUORO-3-HYDROXY-4-[2- (5,5,5-TRIFLUORO-3-HYDROXY-4-{3- METHYL-2-[3-METHYL-2-(3-METHYL- BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}- PENTANOYLAMINO)-PROPIONYLAMINO]- PENTANOIC ACID METHYL ESTER | A,B | 1XE5 | 0.71 | ![]() |
CYK![]() | N-hexanoyl-L-homocysteine | A | 3DHC | 0.7 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A | 3EMY | 0.77 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A | 2H6T | 0.77 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 1LS5 | 0.77 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 1SME | 0.77 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,C | 1W6I | 0.77 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 1XDH | 0.77 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 2QZX | 0.77 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A | 1IZE | 0.77 | ![]() |
IHN![]() | N-(3-methylbutanoyl)-L-valyl-N- [(1R,2R)-4-{[(1R)-2-({(1R)-1-[(1R)- 2-carboxy-1-hydroxyethyl]-3-methylbutyl}amino)- 1-methyl-2-oxoethyl]amino}-2-hydroxy- 1-(2-methylpropyl)-4-oxobutyl]- L-valinamide | A,B | 1M43 | 0.77 | ![]() |
ATI![]() | N-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACID | A | 1Y0Y | 0.71 | ![]() |
ACC![]() | N-[N-[2-AMINO-6-OXO-HEXANOIC ACID- 6-YL]CYSTEINYL]-S-METHYLCYSTEINE | A | 1QIQ | 0.74 | ![]() |
AUA![]() | A,B,C | 1YM2 | 0.72 | ![]() | |
MER![]() | (1R,5S,6S)-2-[(3S,5S)-5-DIMETHYLAMINOCARBONYLPYRROLIDIN- 3-YLTHIO]-6-[(R)-1-HYDROXYETHYL]- 1-METHYLCARBAPEN-2-EM-3-CARBOXYLIC ACID | A,B | 1H8Y | 0.72 | ![]() |
MER![]() | (1R,5S,6S)-2-[(3S,5S)-5-DIMETHYLAMINOCARBONYLPYRROLIDIN- 3-YLTHIO]-6-[(R)-1-HYDROXYETHYL]- 1-METHYLCARBAPEN-2-EM-3-CARBOXYLIC ACID | A | 2ZD8 | 0.72 | ![]() |
MER![]() | (1R,5S,6S)-2-[(3S,5S)-5-DIMETHYLAMINOCARBONYLPYRROLIDIN- 3-YLTHIO]-6-[(R)-1-HYDROXYETHYL]- 1-METHYLCARBAPEN-2-EM-3-CARBOXYLIC ACID | A,B,C,D | 3BFG | 0.72 | ![]() |
AXF![]() | A,B,C | 2F3F | 0.74 | ![]() | |
IVS![]() | 3-HYDROXY-6-METHYL-4-(3-METHYL- 2-(3-METHYL-2-(3-METHYL-BUTYRYLAMINO)- BUTYRYLAMINO)-BUTYRYLAMINO)-HEPTANOIC ACID ETHYL ESTER | A,B | 1ME6 | 0.78 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1K3Y | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1AGS | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1PN9 | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1Q4J | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 2IMK | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 4GSS | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B,C | 1GWC | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B,C,D | 2C3Q | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B,C,D | 1TU8 | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 2GLR | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 2OA7 | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,C | 2AAW | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1VF2 | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A | 1M9A | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 17GS | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1K0A | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 2R3X | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1GSU | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 2C80 | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 2R6K | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1PGT | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 2J9H | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1K3L | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1GNW | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B,C,D | 1BH5 | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 1YDK | 0.72 | ![]() |
GTX![]() | S-HEXYLGLUTATHIONE | A,B | 9GSS | 0.72 | ![]() |
M11![]() | N^6^-[(1R,2S)-1-({[(1R)-1-carboxy- 2-methylpropyl]oxy}carbonyl)-2- sulfanylpropyl]-6-oxo-L-lysine | A | 2VE1 | 0.7 | ![]() |
M11![]() | N^6^-[(1R,2S)-1-({[(1R)-1-carboxy- 2-methylpropyl]oxy}carbonyl)-2- sulfanylpropyl]-6-oxo-L-lysine | A | 2VCM | 0.7 | ![]() |
074![]() | [PROPYLAMINO-3-HYDROXY-BUTAN-1,4- DIONYL]-ISOLEUCYL-PROLINE | A | 1QDQ | 0.71 | ![]() |
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 | 0.73 | ![]() |
GSM![]() | L-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINE | A,B,C,D | 2AB6 | 0.71 | ![]() |
PCJ![]() | (2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE- 1,2-DIYL DIHEXADECANOATE | A,N | 2Z81 | 0.73 | ![]() |
PCJ![]() | (2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE- 1,2-DIYL DIHEXADECANOATE | A,B,C | 2Z7X | 0.73 | ![]() |
FEB![]() | N~2~-[(3R)-3-hydroxydodecanoyl]- L-asparaginyl-N~1~-[(1S)-1-(hydroxymethyl)- 3-methylbutyl]-L-glutamamide | 2,H,K,N,V,Y | 3D29 | 0.72 | ![]() |
OCV![]() | N6-[(1R)-2-{[(1R)-1-CARBOXY-2-METHYLPROPYL]OXY}- 1-(MERCAPTOMETHYL)-2-OXOETHYL]- 6-OXO-D-LYSINE | A | 1HB1 | 0.7 | ![]() |
ACW![]() | D-(L-A-AMINOADIPOYL)-L-CYSTEINYL- B-METHYL-D-CYCLOPROPYLGLYCINE | B | 2IVI | 0.72 | ![]() |
BCV![]() | D-(L-A-AMINOADIPOYL)-L-CYSTEINYL- D-CYCLOPROPYLGLYCINE | A | 2IVJ | 0.72 | ![]() |
W05![]() | DELTA-(L-ALPHA-AMINOADIPOYL)-L- CYSTEINYL-D-ALANINE | A | 1W05 | 0.71 | ![]() |
W05![]() | DELTA-(L-ALPHA-AMINOADIPOYL)-L- CYSTEINYL-D-ALANINE | A | 1W06 | 0.71 | ![]() |
5FP![]() | 5,5,5-TRIFLUORO-3-HYDROXY-4-[2- (5,5,5-TRIFLUORO-3-HYDROXY-4-{3- METHYL-2-[3-METHYL-2-(3-METHYL- BUTYRYLAMINO)-BUTYRYLAMINO]-BUTYRYLAMINO}- PENTANOYLAMINO)-PROPIONYLAMINO]- PENTANOIC ACID | A,B | 1XE6 | 0.71 | ![]() |
VB1![]() | N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}- 2-oxo-1-(sulfanylmethyl)ethyl]- 6-oxo-L-lysine | A | 2VBP | 0.71 | ![]() |
AFJ![]() | (2R,4S,5S)-N-butyl-4-hydroxy-2,7- dimethyl-5-{[N-(4-methylpentanoyl)- L-methionyl]amino}octanamide | A,B,C | 3DUY | 0.82 | ![]() |
AHE![]() | 2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)- 2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]- BUTYRIC ACID | A | 3BHM | 0.72 | ![]() |
AHE![]() | 2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)- 2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]- BUTYRIC ACID | A,B | 1MC5 | 0.72 | ![]() |