Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00452747
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 |
0AG![]() | N-(ethoxycarbonyl)-L-leucine | I,J | 1PSA | 0.85 | ![]() |
BG1![]() | O-[(2S)-2-{methyl[(methylamino)sulfonyl]amino}pentanoyl]- L-serine | A | 2RG3 | 0.71 | ![]() |
MLE![]() | N-METHYLLEUCINE | A,D | 2J9A | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1IKF | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A,M,N | 2Z6W | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | B,D,F,H,J,L, N,P | 1C5F | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | D,E,F | 1XQ7 | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWA | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWF | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | B,D,F,H,J,L, N,P,R,T | 2RMB | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | B | 3CYS | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWH | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A,B,C,D,E,F, G,H | 3BO7 | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CYN | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A | 1LV9 | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C,D | 2OJU | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | B,D,F,H,J,L, N,P,R,T | 2RMA | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A | 1IKM | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWK | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A,B | 2HG8 | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWB | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWJ | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A | 1CYB | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | D | 1QNG | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | B | 1MIK | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A | 1CSA | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWL | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A | 1CYA | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A,B,D | 1MF8 | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1BCK | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A,B,D,E,F,H | 1M63 | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWC | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWI | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C,D | 1QNH | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | B,D,F,H | 2RMC | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWM | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | T,U,V | 2POY | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A,B,C,D,E,F, I,J,K,L,M,N | 2ESL | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | C | 1CWO | 0.74 | ![]() |
MLE![]() | N-METHYLLEUCINE | A | 1IKL | 0.74 | ![]() |
76V![]() | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCYL-L-ISOLEUCINE | A | 2DCB | 0.7 | ![]() |
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 | ![]() |
C6L![]() | N-hexanoyl-L-homoserine | A | 3DHA | 0.71 | ![]() |
C6L![]() | N-hexanoyl-L-homoserine | A | 3DHB | 0.71 | ![]() |
SVC![]() | N-ACETYL-L-LEUCYL-N-[(1S)-4-{[AMINO(IMINO)METHYL]AMINO}- 1-(HYDROXYMETHYL)BUTYL]-L-LEUCINAMIDE | A,B | 3BPM | 0.71 | ![]() |
X7O![]() | 5-AMINO-3-METHYL-PYRROLIDINE-2- CARBOXYLIC ACID | A | 1L2Q | 0.7 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1AEC | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A,B | 2PRE | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1CV8 | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 3C9E | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A,B | 3BCN | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1ATK | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A,B,C,D | 3BPF | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1TLO | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1QX6 | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A | 1MEG | 0.71 | ![]() |
E64![]() | N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- BUTYL]-GUANIDINE | A,B,C,D | 2BDZ | 0.71 | ![]() |
ATI![]() | N-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACID | A | 1Y0Y | 0.72 | ![]() |
LBY![]() | N~6~-(TERT-BUTOXYCARBONYL)-L-LYSINE | A | 2ZIN | 0.72 | ![]() |
IML![]() | N-METHYL-ISOLEUCINE | C | 1CWM | 0.71 | ![]() |
MDZ![]() | N~6~-METHYL-6-OXO-L-LYSINE - 2- [(3-MERCAPTOBUTANOYL)OXY]-3-METHYLBUTANOIC ACID | A | 1W3V | 0.7 | ![]() |
MHL![]() | N-METHYL-4-HYDROXY-LEUCINE | C | 1CWL | 0.72 | ![]() |
U17![]() | METHYL N-[(2S,3R)-3-AMINO-2-HYDROXYHEPTANOYL]- L-SERYL-L-LEUCINATE | A | 2GGB | 0.72 | ![]() |
MNL![]() | 4,N-DIMETHYLNORLEUCINE | C | 1CWC | 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 | 0.71 | ![]() |
OLN![]() | (S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACID | A | 1YH1 | 0.75 | ![]() |
MUD![]() | N-{[(1R)-1-carboxy-2-(methylsulfanyl)ethyl]carbamoyl}- L-glutamic acid | A | 3D7G | 0.71 | ![]() |
59A![]() | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCINE | A | 2DC8 | 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 | ![]() |
CDV![]() | 3-METHYL-2-UREIDO-BUTYRIC ACID | B | 1UF7 | 0.77 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1PPP | 0.73 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1PE6 | 0.73 | ![]() |
E6C![]() | N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO- 2-METHYL-BUTANE | A | 1ITO | 0.73 | ![]() |
CCL![]() | N~6~-[(CYCLOPENTYLOXY)CARBONYL]- D-LYSINE | A | 2Q7G | 0.73 | ![]() |
IVS![]() | 3-HYDROXY-6-METHYL-4-(3-METHYL- 2-(3-METHYL-2-(3-METHYL-BUTYRYLAMINO)- BUTYRYLAMINO)-BUTYRYLAMINO)-HEPTANOIC ACID ETHYL ESTER | A,B | 1ME6 | 0.73 | ![]() |
C99![]() | {(2R)-2-[(1S,2R)-1-AMINO-2-HYDROXYPROPYL]- 2-HYDROXY-4,5-DIOXOIMIDAZOLIDIN- 1-YL}ACETIC ACID | A | 2HCG | 0.7 | ![]() |
OCV![]() | N6-[(1R)-2-{[(1R)-1-CARBOXY-2-METHYLPROPYL]OXY}- 1-(MERCAPTOMETHYL)-2-OXOETHYL]- 6-OXO-D-LYSINE | A | 1HB1 | 0.7 | ![]() |
D20![]() | N~5~-{IMINO[(2-METHOXYETHYL)AMINO]METHYL}- L-ORNITHINE | A,B | 2JAJ | 0.7 | ![]() |
AN0![]() | N-ACETYL-L-NORVALINE | C,D,E,X,Y,Z | 2G7M | 0.7 | ![]() |
AN0![]() | N-ACETYL-L-NORVALINE | A | 1ZQ8 | 0.7 | ![]() |
75V![]() | N-{[(2S,3S)-3-(ETHOXYCARBONYL)OXIRAN- 2-YL]CARBONYL}-L-ISOLEUCYL-L-ALANINE | A | 2DCA | 0.7 | ![]() |
DLS![]() | DI-ACETYL-LYSINE | A,B,C,D,E,F | 1FVM | 0.72 | ![]() |