Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00290234
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 |
ML3 | 2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}- N,N,N-trimethylethanaminium | F | 3C1B | 0.74 | |
TGG | GAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINE | A | 2F2K | 0.73 | |
TGG | GAMMA-GLUTAMYL-S-(1,2-DICARBOXYETHYL)CYSTEINYLGLYCINE | A,B | 2V6K | 0.73 | |
IP1 | ISOPENICILLIN N | A | 1QJE | 0.72 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1K3Y | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1AGS | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1PN9 | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1Q4J | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 2IMK | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 4GSS | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B,C | 1GWC | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B,C,D | 2C3Q | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B,C,D | 1TU8 | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 2GLR | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 2OA7 | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,C | 2AAW | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1VF2 | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A | 1M9A | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 17GS | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1K0A | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 2R3X | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1GSU | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 2C80 | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 2R6K | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1PGT | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 2J9H | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1K3L | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1GNW | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B,C,D | 1BH5 | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 1YDK | 0.76 | |
GTX | S-HEXYLGLUTATHIONE | A,B | 9GSS | 0.76 | |
CYK | N-hexanoyl-L-homocysteine | A | 3DHC | 0.73 | |
AME | N-ACETYLMETHIONINE | A,B,C,D | 1SJA | 0.72 | |
AME | N-ACETYLMETHIONINE | A,B | 2J4Y | 0.72 | |
AHE | 2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)- 2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]- BUTYRIC ACID | A | 3BHM | 0.71 | |
AHE | 2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)- 2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]- BUTYRIC ACID | A,B | 1MC5 | 0.71 | |
CY1 | ACETAMIDOMETHYLCYSTEINE | A,D | 1D5M | 0.7 | |
SMG | N-SUCCINYL METHIONINE | A,B,C,D | 1SJC | 0.77 | |
GSM | L-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINE | A,B,C,D | 2AB6 | 0.74 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,B | 1OEX | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A | 2OWX | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,I | 1GVW | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,I | 1GVX | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A | 2OWW | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,B | 1GKT | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A | 2OWC | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,I | 1GVV | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,I | 1GVT | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,B | 2VS2 | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A | 1OEW | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,I | 1GVU | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,B | 2JJJ | 0.7 | |
SUI | (3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID | A,B | 2JJI | 0.7 | |
GTY | L-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINE | A | 1U88 | 0.73 | |
W05 | DELTA-(L-ALPHA-AMINOADIPOYL)-L- CYSTEINYL-D-ALANINE | A | 1W05 | 0.7 | |
W05 | DELTA-(L-ALPHA-AMINOADIPOYL)-L- CYSTEINYL-D-ALANINE | A | 1W06 | 0.7 | |
VB1 | N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}- 2-oxo-1-(sulfanylmethyl)ethyl]- 6-oxo-L-lysine | A | 2VBP | 0.7 | |
SHC | S-HEXYLCYSTEINE | I,J | 1GSS | 0.71 | |
M2L | (2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acid | A | 2K3Y | 0.72 | |
M2L | (2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acid | A,E | 3C1C | 0.72 | |
EPM | N-PALMITOYL-L-METHIONINE | A,B | 1ZO9 | 0.73 | |
ACC | N-[N-[2-AMINO-6-OXO-HEXANOIC ACID- 6-YL]CYSTEINYL]-S-METHYLCYSTEINE | A | 1QIQ | 0.73 | |
SIC | (2R)-2-[(3S)-3-amino-2,5-dioxopyrrolidin- 1-yl]-3-sulfanylpropanoic acid | A,B | 3DIP | 0.77 | |
RCY | S-[(3S,3'R)-1'-hydroxy-2',2',5',5'- tetramethyl-2,5-dioxo-1,3'-bipyrrolidin- 3-yl]-L-cysteine | A | 2JU4 | 0.84 | |
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 | 0.72 |