Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03287072
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 |
SIM | SIMVASTATIN | A,B,C,D | 1HW9 | 0.73 | |
B2S | (3alpha,7alpha)-3,7,15-trihydroxy- 12,13-epoxytrichothec-9-en-8-one | A | 3B2S | 0.79 | |
DGX | DIGOXIN | B,D | 1IGJ | 0.73 | |
PRB | 13-ACETYLPHORBOL | A | 1PTR | 0.71 | |
TG1 | A,B | 2AGV | 0.75 | ||
TG1 | A | 2ZBF | 0.75 | ||
TG1 | A | 2ZBG | 0.75 | ||
TG1 | A,B,C,D | 1WPG | 0.75 | ||
TG1 | A | 2C8L | 0.75 | ||
TG1 | A | 2EAR | 0.75 | ||
TG1 | A,B | 1IWO | 0.75 | ||
TG1 | A | 2C88 | 0.75 | ||
TG1 | A | 2DQS | 0.75 | ||
TG1 | A | 2C8K | 0.75 | ||
TG1 | A | 1XP5 | 0.75 | ||
TG1 | A | 2EAT | 0.75 | ||
FUA | FUSIDIC ACID | A | 1QCA | 0.74 | |
FUA | FUSIDIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1Q23 | 0.74 | |
FUA | FUSIDIC ACID | A,B | 2VUF | 0.74 | |
C3O | 2ALPHA-PROPOXY-1ALPHA,25-DIHYDROXYVITAMIN D3 | A | 2HAS | 0.71 | |
GMM | GLUCOSE MONOMYCOLATE | A | 1UQS | 0.71 | |
FOK | FORSKOLIN | A,C | 3C16 | 0.72 | |
FOK | FORSKOLIN | A,C | 1CJU | 0.72 | |
FOK | FORSKOLIN | A,C | 1TL7 | 0.72 | |
FOK | FORSKOLIN | A,B | 1AB8 | 0.72 | |
FOK | FORSKOLIN | A,C | 3C14 | 0.72 | |
FOK | FORSKOLIN | A,C | 1CJT | 0.72 | |
FOK | FORSKOLIN | A,B,C | 1CUL | 0.72 | |
FOK | FORSKOLIN | A,C | 1CJV | 0.72 | |
FOK | FORSKOLIN | A,C | 3C15 | 0.72 | |
FOK | FORSKOLIN | A,C | 1U0H | 0.72 | |
FOK | FORSKOLIN | A,B,C | 1CS4 | 0.72 | |
FOK | FORSKOLIN | A,C | 1CJK | 0.72 | |
GR4 | H,I | 1AWF | 0.71 | ||
OKA | OKADAIC ACID | A | 1JK7 | 0.71 | |
OKA | OKADAIC ACID | C | 2IE4 | 0.71 | |
OKA | OKADAIC ACID | A | 1U32 | 0.71 | |
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 | 0.76 | |
OCC | 2ALPHA-(3-HYDROXYPROPOXY)-1ALPHA,25- DIHYDROXYVITAMIN D3 | A | 2HAR | 0.71 | |
FSC | FUSICOCCIN | A | 1O9E | 0.79 | |
FSC | FUSICOCCIN | A,P | 1O9F | 0.79 | |
FSC | FUSICOCCIN | A,B | 2O98 | 0.79 | |
CW1 | Cotylenin A | A,B,C,D | 3E6Y | 0.72 | |
SXN | Salinixanthin | A,B | 3DDL | 0.73 | |
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 | 0.7 | |
MRC | MUPIROCIN | A | 1JZS | 0.77 | |
MRC | MUPIROCIN | A,T | 1FFY | 0.77 | |
MRC | MUPIROCIN | A | 1QU3 | 0.77 | |
MRC | MUPIROCIN | A,T | 1QU2 | 0.77 | |
DOG | DIGOXIGENIN | A | 1LKE | 0.74 | |
SRN | SORANGICIN A | C,D | 1YNJ | 0.75 | |
AUR | AUROVERTIN B | A,B,C,D,E,F | 1COW | 0.79 | |
LVA | (3R,5R)-7-((1R,2R,6S,8R,8AS)-2,6- DIMETHYL-8-{[(2R)-2-METHYLBUTANOYL]OXY}- 1,2,6,7,8,8A-HEXAHYDRONAPHTHALEN- 1-YL)-3,5-DIHYDROXYHEPTANOIC ACID | A,B | 1T02 | 0.71 | |
114 | COMPACTIN | A,B,C,D | 1HW8 | 0.71 | |
DTX | DIGITOXIGENIN | A | 1LNM | 0.73 | |
PID | PERIDININ | A | 2C9E | 0.75 | |
PID | PERIDININ | M,N,O | 1PPR | 0.75 | |
NEX | A,B,C,D,E,F, G,H,I,J | 1RWT | 0.71 | ||
NEX | A,B,C | 2BHW | 0.71 | ||
ZBA | 12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate | A | 2RKV | 0.96 | |
ZBA | 12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate | A,B,C,D | 2ZBA | 0.96 | |
GA3 | GIBBERELLIN A3 | A | 2ZSH | 0.71 | |
GA3 | GIBBERELLIN A3 | A,B,C,D,E,F | 3ED1 | 0.71 | |
AB0 | 3,7:6,10:9,14-TRIANHYDRO-2,5,11,12,13- PENTADEOXY-4-O-(METHOXYMETHYL)- L-ARABINO-L-ALLO-TETRADEC-12-ENONIC ACID | H,L | 2E27 | 0.72 | |
FUG | FUMAGILLIN | A,B | 3FMQ | 0.72 | |
FUG | FUMAGILLIN | A | 1BOA | 0.72 | |
OBN | OUABAIN | H,L | 1IBG | 0.75 |