Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02244857
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 |
LNT | N-[(2S)-2-amino-1,1-dihydroxy-4- methylpentyl]-L-threonine | A,B,C | 3B80 | 0.75 | |
LNT | N-[(2S)-2-amino-1,1-dihydroxy-4- methylpentyl]-L-threonine | A,B,C | 3B7V | 0.75 | |
REZ | (2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}- 7-OXOHEPTANOIC ACID | A,B | 2J9P | 0.7 | |
REZ | (2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}- 7-OXOHEPTANOIC ACID | A,B,C,D | 2VGK | 0.7 | |
IVS | 3-HYDROXY-6-METHYL-4-(3-METHYL- 2-(3-METHYL-2-(3-METHYL-BUTYRYLAMINO)- BUTYRYLAMINO)-BUTYRYLAMINO)-HEPTANOIC ACID ETHYL ESTER | A,B | 1ME6 | 0.76 | |
168 | PANTOTHENYL-AMINOETHANOL-ACETATE PIVALIC ACID | A,B,C,D | 1OU6 | 0.75 | |
SN0 | N-(3-CARBOXYPROPANOYL)-L-NORVALINE | A | 2G65 | 0.73 | |
SN0 | N-(3-CARBOXYPROPANOYL)-L-NORVALINE | A | 2G6A | 0.73 | |
SN0 | N-(3-CARBOXYPROPANOYL)-L-NORVALINE | A | 2G68 | 0.73 | |
SN0 | N-(3-CARBOXYPROPANOYL)-L-NORVALINE | C,D,E,X,Y,Z | 2FG7 | 0.73 | |
SN0 | N-(3-CARBOXYPROPANOYL)-L-NORVALINE | A | 2G6C | 0.73 | |
SN0 | N-(3-CARBOXYPROPANOYL)-L-NORVALINE | C,D,E,X,Y,Z | 2FG6 | 0.73 | |
E6C | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1PPP | 0.8 | |
E6C | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1PE6 | 0.8 | |
E6C | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1ITO | 0.8 | |
INC | 2-(ACETYL-HYDROXY-AMINO)-4-METHYL- PENTANOIC ACID METHYL ESTER | A | 7TLN | 0.77 | |
NLG | N-ACETYL-L-GLUTAMATE | A | 1OH9 | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A | 1OHA | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A,B,C,D,E,F, G,H,I,J,K,L | 2BUF | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A,B,C,D | 2RD5 | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A,B | 2JJ4 | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A,B,C,D,E,F, G,H,J,K | 2V5H | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A | 1GSJ | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A | 3B8G | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A | 1GS5 | 0.7 | |
NLG | N-ACETYL-L-GLUTAMATE | A,B,C | 2BTY | 0.7 | |
MNL | 4,N-DIMETHYLNORLEUCINE | C | 1CWC | 0.7 | |
042 | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-THREONYL-L-ISOLEUCINE | A | 2DC7 | 0.76 | |
074 | [PROPYLAMINO-3-HYDROXY-BUTAN-1,4- DIONYL]-ISOLEUCYL-PROLINE | A | 1QDQ | 0.74 | |
MDZ | N~6~-METHYL-6-OXO-L-LYSINE - 2- [(3-MERCAPTOBUTANOYL)OXY]-3-METHYLBUTANOIC ACID | A | 1W3V | 0.77 | |
MLE | N-METHYLLEUCINE | A,D | 2J9A | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1IKF | 0.72 | |
MLE | N-METHYLLEUCINE | A,M,N | 2Z6W | 0.72 | |
MLE | N-METHYLLEUCINE | B,D,F,H,J,L, N,P | 1C5F | 0.72 | |
MLE | N-METHYLLEUCINE | D,E,F | 1XQ7 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWA | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWF | 0.72 | |
MLE | N-METHYLLEUCINE | B,D,F,H,J,L, N,P,R,T | 2RMB | 0.72 | |
MLE | N-METHYLLEUCINE | B | 3CYS | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWH | 0.72 | |
MLE | N-METHYLLEUCINE | A,B,C,D,E,F, G,H | 3BO7 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CYN | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1LV9 | 0.72 | |
MLE | N-METHYLLEUCINE | C,D | 2OJU | 0.72 | |
MLE | N-METHYLLEUCINE | B,D,F,H,J,L, N,P,R,T | 2RMA | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1IKM | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWK | 0.72 | |
MLE | N-METHYLLEUCINE | A,B | 2HG8 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWB | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWJ | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1CYB | 0.72 | |
MLE | N-METHYLLEUCINE | D | 1QNG | 0.72 | |
MLE | N-METHYLLEUCINE | B | 1MIK | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1CSA | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWL | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1CYA | 0.72 | |
MLE | N-METHYLLEUCINE | A,B,D | 1MF8 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1BCK | 0.72 | |
MLE | N-METHYLLEUCINE | A,B,D,E,F,H | 1M63 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWC | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWI | 0.72 | |
MLE | N-METHYLLEUCINE | C,D | 1QNH | 0.72 | |
MLE | N-METHYLLEUCINE | B,D,F,H | 2RMC | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWM | 0.72 | |
MLE | N-METHYLLEUCINE | T,U,V | 2POY | 0.72 | |
MLE | N-METHYLLEUCINE | A,B,C,D,E,F, I,J,K,L,M,N | 2ESL | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWO | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1IKL | 0.72 | |
76V | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCYL-L-ISOLEUCINE | A | 2DCB | 0.75 | |
THC | N-METHYLCARBONYLTHREONINE | A,B,C | 1A7C | 0.74 | |
THC | N-METHYLCARBONYLTHREONINE | B | 2HR0 | 0.74 | |
THC | N-METHYLCARBONYLTHREONINE | L,P | 2MPA | 0.74 | |
THC | N-METHYLCARBONYLTHREONINE | L,P | 1MPA | 0.74 | |
TMD | (6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N- DIMETHYL-THREONINE | C | 1CWK | 0.7 | |
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 | 0.7 | |
OPI | PANTOTHENYL-AMINOETHANOL-11-PIVALIC ACID | A,B,C,D | 2VU1 | 0.74 | |
V10 | N^6^-[(1R)-2-[(1R)-1-carboxy-2- (methylsulfanyl)ethoxy]-2-oxo-1- (sulfanylmethyl)ethyl]-6-oxo-L- lysine | A | 2VBD | 0.7 | |
59A | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCINE | A | 2DC8 | 0.8 | |
RO4 | [[1-[N-HYDROXY-ACETAMIDYL]-3-METHYL- BUTYL]-CARBONYL-LEUCINYL]-ALANINE ETHYL ESTER | A | 2TCL | 0.73 | |
EP2 | methyl N-[(2S)-4-{[(1S)-1-{[(2S)- 2-carboxypyrrolidin-1-yl]carbonyl}- 3-methylbutyl]amino}-2-hydroxy- 4-oxobutanoyl]-L-leucylglycylglycinate | B | 1SP4 | 0.73 | |
ATI | N-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACID | A | 1Y0Y | 0.76 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1AEC | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A,B | 2PRE | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1CV8 | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 3C9E | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A,B | 3BCN | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1ATK | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A,B,C,D | 3BPF | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1TLO | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1QX6 | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1MEG | 0.72 | |
E64 | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A,B,C,D | 2BDZ | 0.72 | |
UDC | (2S,3S)-2-((2S,3R,4S,5R)-5-ETHANAMIDO- 3-HYDROXY-2-(HYDROXYMETHYL)TETRAHYDRO- 2H-PYRAN-4-YLOXY)-3,4-DIHYDROXY- 2-METHYLBUTANOIC ACID | A,B,C,D | 2Z2C | 0.7 | |
DLS | DI-ACETYL-LYSINE | A,B,C,D,E,F | 1FVM | 0.73 | |
PAU | PANTOTHENOIC ACID | A,B | 2F9W | 0.74 | |
PAU | PANTOTHENOIC ACID | A,B,C,D,E,F | 3BF1 | 0.74 | |
PAU | PANTOTHENOIC ACID | A,B,C,D | 1SQ5 | 0.74 | |
PAU | PANTOTHENOIC ACID | A,B,C,D,E,F | 3BEX | 0.74 | |
M11 | N^6^-[(1R,2S)-1-({[(1R)-1-carboxy- 2-methylpropyl]oxy}carbonyl)-2- sulfanylpropyl]-6-oxo-L-lysine | A | 2VE1 | 0.77 | |
M11 | N^6^-[(1R,2S)-1-({[(1R)-1-carboxy- 2-methylpropyl]oxy}carbonyl)-2- sulfanylpropyl]-6-oxo-L-lysine | A | 2VCM | 0.77 | |
75V | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCYL-L-ALANINE | A | 2DCA | 0.75 | |
AN0 | N-ACETYL-L-NORVALINE | C,D,E,X,Y,Z | 2G7M | 0.74 | |
AN0 | N-ACETYL-L-NORVALINE | A | 1ZQ8 | 0.74 | |
SCV | N6-[(1S)-2-{[(1R)-1-CARBOXY-2-METHYLPROPYL]OXY}- 1-(MERCAPTOCARBONYL)-2-OXOETHYL]- 6-OXO-L-LYSINE | A | 1HB2 | 0.75 | |
SCV | N6-[(1S)-2-{[(1R)-1-CARBOXY-2-METHYLPROPYL]OXY}- 1-(MERCAPTOCARBONYL)-2-OXOETHYL]- 6-OXO-L-LYSINE | A | 1HB4 | 0.75 | |
SCV | N6-[(1S)-2-{[(1R)-1-CARBOXY-2-METHYLPROPYL]OXY}- 1-(MERCAPTOCARBONYL)-2-OXOETHYL]- 6-OXO-L-LYSINE | A | 1HB3 | 0.75 | |
LAE | 3-OXO-OCTANOIC ACID (2-OXO-TETRAHYDRO- FURAN-3-YL)-AMIDE | A,B,C,D | 1L3L | 0.7 | |
LAE | 3-OXO-OCTANOIC ACID (2-OXO-TETRAHYDRO- FURAN-3-YL)-AMIDE | A,B | 2Q0O | 0.7 | |
V20 | N6^-[(1R)-2-[(1S)-1-CARBOXY-2-(METHYLSULFANYL)ETHOXY]- 2-OXO-1-(SULFANYLMETHYL)ETHYL]- 6-OXO-L-LYSINE | A | 2VAU | 0.7 | |
0AG | N-(ethoxycarbonyl)-L-leucine | I,J | 1PSA | 0.83 | |
74M | METHYL N-({(2S,3S)-3-[(PROPYLAMINO)CARBONYL]OXIRAN- 2-YL}CARBONYL)-L-ISOLEUCYL-L-PROLINATE | A | 2DC9 | 0.72 | |
DH9 | (2S,3S,5S)-5-[(N-FORMYL-L-LEUCYL)OXY]- 2-HEXYL-3-HYDROXYHEXADECANOIC ACID | A,B | 2PX6 | 0.72 | |
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 | 0.72 | |
CLG | 2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)- ACETYLAMINO]-HEXANOIC ACID | A,B | 1K09 | 0.73 | |
IML | N-METHYL-ISOLEUCINE | C | 1CWM | 0.7 | |
HTF | N-(2-OXOTETRAHYDROFURAN-3-YL)OCTANAMIDE | A | 2AVX | 0.71 | |
097 | (2S,3R)-N~4~-[(1S)-2,2-dimethyl- 1-(methylcarbamoyl)propyl]-N~1~,2- dihydroxy-3-(2-methylpropyl)butanediamide | A,B | 3HY7 | 0.71 | |
097 | (2S,3R)-N~4~-[(1S)-2,2-dimethyl- 1-(methylcarbamoyl)propyl]-N~1~,2- dihydroxy-3-(2-methylpropyl)butanediamide | A,B | 2JIH | 0.71 | |
097 | (2S,3R)-N~4~-[(1S)-2,2-dimethyl- 1-(methylcarbamoyl)propyl]-N~1~,2- dihydroxy-3-(2-methylpropyl)butanediamide | A | 1R55 | 0.71 | |
C6L | N-hexanoyl-L-homoserine | A | 3DHA | 0.75 | |
C6L | N-hexanoyl-L-homoserine | A | 3DHB | 0.75 | |
U17 | METHYL N-[(2S,3R)-3-AMINO-2-HYDROXYHEPTANOYL]- L-SERYL-L-LEUCINATE | A | 2GGB | 0.79 | |
OCV | N6-[(1R)-2-{[(1R)-1-CARBOXY-2-METHYLPROPYL]OXY}- 1-(MERCAPTOMETHYL)-2-OXOETHYL]- 6-OXO-D-LYSINE | A | 1HB1 | 0.77 |