Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03275482
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 |
SRN | SORANGICIN A | C,D | 1YNJ | 0.71 | |
PID | PERIDININ | A | 2C9E | 0.71 | |
PID | PERIDININ | M,N,O | 1PPR | 0.71 | |
20E | (2beta,3beta,5beta,22R)-2,3,14,20,22,25- hexahydroxycholest-7-en-6-one | A,D | 2R40 | 0.75 | |
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 | |
TG1 | A,B | 2AGV | 0.73 | ||
TG1 | A | 2ZBF | 0.73 | ||
TG1 | A | 2ZBG | 0.73 | ||
TG1 | A,B,C,D | 1WPG | 0.73 | ||
TG1 | A | 2C8L | 0.73 | ||
TG1 | A | 2EAR | 0.73 | ||
TG1 | A,B | 1IWO | 0.73 | ||
TG1 | A | 2C88 | 0.73 | ||
TG1 | A | 2DQS | 0.73 | ||
TG1 | A | 2C8K | 0.73 | ||
TG1 | A | 1XP5 | 0.73 | ||
TG1 | A | 2EAT | 0.73 | ||
PRB | 13-ACETYLPHORBOL | A | 1PTR | 0.79 | |
ZBA | 12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate | A | 2RKV | 0.83 | |
ZBA | 12,13-Epoxytrichothec-9-ene-3,4,8,15- tetrol-4,15-diacetate-8-isovalerate | A,B,C,D | 2ZBA | 0.83 | |
DEX | DEXAMETHASONE | A,D | 1M2Z | 0.71 | |
DEX | DEXAMETHASONE | A,B,C,D | 1P93 | 0.71 | |
P1A | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | A,D | 1R1K | 0.75 | |
P1A | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | E,U | 1Z5X | 0.75 | |
P1A | 2,3,14,20,22-PENTAHYDROXYCHOLEST- 7-EN-6-ONE | E,F,G,H | 2NXX | 0.75 | |
B2S | (3alpha,7alpha)-3,7,15-trihydroxy- 12,13-epoxytrichothec-9-en-8-one | A | 3B2S | 1 | |
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 | |
ZK5 | 9ALPHA-FLUOROCORTISOL | A | 1GS4 | 0.7 | |
OVA | 3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE | A | 2GZ5 | 0.76 | |
OVA | 3,4-DIHYDROXY-2-METHOXY-4-METHYL- 3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) - OXIRANYL]-CYCLOHEXANONE | A | 1B59 | 0.76 | |
FOK | FORSKOLIN | A,C | 3C16 | 0.71 | |
FOK | FORSKOLIN | A,C | 1CJU | 0.71 | |
FOK | FORSKOLIN | A,C | 1TL7 | 0.71 | |
FOK | FORSKOLIN | A,B | 1AB8 | 0.71 | |
FOK | FORSKOLIN | A,C | 3C14 | 0.71 | |
FOK | FORSKOLIN | A,C | 1CJT | 0.71 | |
FOK | FORSKOLIN | A,B,C | 1CUL | 0.71 | |
FOK | FORSKOLIN | A,C | 1CJV | 0.71 | |
FOK | FORSKOLIN | A,C | 3C15 | 0.71 | |
FOK | FORSKOLIN | A,C | 1U0H | 0.71 | |
FOK | FORSKOLIN | A,B,C | 1CS4 | 0.71 | |
FOK | FORSKOLIN | A,C | 1CJK | 0.71 | |
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 | |
MRC | MUPIROCIN | A | 1JZS | 0.74 | |
MRC | MUPIROCIN | A,T | 1FFY | 0.74 | |
MRC | MUPIROCIN | A | 1QU3 | 0.74 | |
MRC | MUPIROCIN | A,T | 1QU2 | 0.74 |