Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02519009
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 |
E7B | A,B | 3E7B | 0.7 | ||
20E | (2beta,3beta,5beta,22R)-2,3,14,20,22,25- hexahydroxycholest-7-en-6-one | A,D | 2R40 | 0.74 | |
SRN | SORANGICIN A | C,D | 1YNJ | 0.71 | |
PXT | PECTENOTOXIN-2 | A | 2Q0U | 0.73 | |
PXT | PECTENOTOXIN-2 | A | 2Q0R | 0.73 | |
TG1 | A,B | 2AGV | 0.77 | ||
TG1 | A | 2ZBF | 0.77 | ||
TG1 | A | 2ZBG | 0.77 | ||
TG1 | A,B,C,D | 1WPG | 0.77 | ||
TG1 | A | 2C8L | 0.77 | ||
TG1 | A | 2EAR | 0.77 | ||
TG1 | A,B | 1IWO | 0.77 | ||
TG1 | A | 2C88 | 0.77 | ||
TG1 | A | 2DQS | 0.77 | ||
TG1 | A | 2C8K | 0.77 | ||
TG1 | A | 1XP5 | 0.77 | ||
TG1 | A | 2EAT | 0.77 | ||
OKA | OKADAIC ACID | A | 1JK7 | 0.72 | |
OKA | OKADAIC ACID | C | 2IE4 | 0.72 | |
OKA | OKADAIC ACID | A | 1U32 | 0.72 | |
GR4 | H,I | 1AWF | 0.77 | ||
B2S | (3alpha,7alpha)-3,7,15-trihydroxy- 12,13-epoxytrichothec-9-en-8-one | A | 3B2S | 0.76 | |
13T | 13-DEOXYTEDANOLIDE | 0,1,3,9,A,B, C,H,J,K,L,M, N,O,Q,R,S,T, U,Y,Z | 2OTJ | 0.71 | |
GA3 | GIBBERELLIN A3 | A | 2ZSH | 0.73 | |
GA3 | GIBBERELLIN A3 | A,B,C,D,E,F | 3ED1 | 0.73 | |
GR3 | 3-ACETOXY-17-(1-FORMYL-5-METHYL- 3-OXO-HEX-4-ENYL)-16-HYDROXY-4,10,13,14- TETRAMETHYL-2,3,4,5,6,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHRENE- 4-CARBOXYLIC ACID | B,D | 1AWH | 0.73 | |
NTH | SUCCINIC ACID MONO-(13-METHYL-3- OXO-2,3,6,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 17-YL) ESTER | A,B | 1BUQ | 0.7 | |
DGX | DIGOXIN | B,D | 1IGJ | 0.7 | |
MOU | A,B | 2NPF | 0.71 | ||
FOK | FORSKOLIN | A,C | 3C16 | 0.8 | |
FOK | FORSKOLIN | A,C | 1CJU | 0.8 | |
FOK | FORSKOLIN | A,C | 1TL7 | 0.8 | |
FOK | FORSKOLIN | A,B | 1AB8 | 0.8 | |
FOK | FORSKOLIN | A,C | 3C14 | 0.8 | |
FOK | FORSKOLIN | A,C | 1CJT | 0.8 | |
FOK | FORSKOLIN | A,B,C | 1CUL | 0.8 | |
FOK | FORSKOLIN | A,C | 1CJV | 0.8 | |
FOK | FORSKOLIN | A,C | 3C15 | 0.8 | |
FOK | FORSKOLIN | A,C | 1U0H | 0.8 | |
FOK | FORSKOLIN | A,B,C | 1CS4 | 0.8 | |
FOK | FORSKOLIN | A,C | 1CJK | 0.8 | |
ZK5 | 9ALPHA-FLUOROCORTISOL | A | 1GS4 | 0.7 | |
FUA | FUSIDIC ACID | A | 1QCA | 0.71 | |
FUA | FUSIDIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1Q23 | 0.71 | |
FUA | FUSIDIC ACID | A,B | 2VUF | 0.71 | |
ZBA | 12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate | A | 2RKV | 0.72 | |
ZBA | 12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate | A,B,C,D | 2ZBA | 0.72 | |
P1A | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | A,D | 1R1K | 0.74 | |
P1A | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | E,U | 1Z5X | 0.74 | |
P1A | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | E,F,G,H | 2NXX | 0.74 | |
PRB | 13-ACETYLPHORBOL | A | 1PTR | 0.74 | |
WIN | methyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)- 15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}- 3,11,12-trihydroxy-2,16-dioxo-13,20- epoxypicras-3-en-21-oate | 0,1,2,3,9,A, B,C,F,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 3G71 | 0.99 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A,B | 2CBT | 0.71 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A,B,C,D,E,F | 2CBQ | 0.71 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A | 2CBO | 0.71 | |
OBN | OUABAIN | H,L | 1IBG | 0.73 | |
HCY | (11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione | A,B | 2VDY | 0.72 | |
HCY | (11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione | A | 2V95 | 0.72 | |
SIH | PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE | H | 1DBM | 0.73 |