Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03128780
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 |
HND | (4S)-nonane-1,4-diol | A | 2KAR | 0.76 | |
HND | (4S)-nonane-1,4-diol | A | 2KAS | 0.76 | |
ASO | 1,5-ANHYDROSORBITOL | A | 1XIE | 0.71 | |
ASO | 1,5-ANHYDROSORBITOL | A | 3GUH | 0.71 | |
ASO | 1,5-ANHYDROSORBITOL | A,B | 2ASV | 0.71 | |
ASO | 1,5-ANHYDROSORBITOL | H,L | 2EC9 | 0.71 | |
HE4 | HEPTAN-1-OL | A | 1ZNG | 0.74 | |
PE9 | PENTAN-1-OL | A | 1ZND | 0.75 | |
SOR | D-SORBITOL | A | 1FQA | 0.82 | |
SOR | D-SORBITOL | A,B,C,D | 3XIM | 0.82 | |
SOR | D-SORBITOL | A | 2VFT | 0.82 | |
SOR | D-SORBITOL | A,B,C,D | 5XIM | 0.82 | |
SOR | D-SORBITOL | A | 3BRF | 0.82 | |
SOR | D-SORBITOL | A | 1XIH | 0.82 | |
SOR | D-SORBITOL | A | 2DXR | 0.82 | |
SOR | D-SORBITOL | A | 1D8C | 0.82 | |
SOR | D-SORBITOL | A,B,C,D | 2XIN | 0.82 | |
SOR | D-SORBITOL | A | 1FQB | 0.82 | |
SOR | D-SORBITOL | A,B | 4XIA | 0.82 | |
CXL | CYCLOHEXANOL | A,B | 1HDX | 0.8 | |
CBU | (1R,2R,3S,4S,5S,6S)-CYCLOHEXANE- 1,2,3,4,5,6-HEXOL | A,B | 2VT0 | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 3BXD | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1IEV | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1PTG | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B,C | 2OS9 | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B,C,D | 2R71 | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 1G0I | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 2HUO | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 1Y7V | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A | 1AOD | 0.77 | |
INS | 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE | A,B | 3EA2 | 0.77 | |
XYL | D-XYLITOL | A,B | 1XLC | 0.73 | |
XYL | D-XYLITOL | A | 1S5N | 0.73 | |
XYL | D-XYLITOL | A | 1W3Y | 0.73 | |
XYL | D-XYLITOL | A | 1NJR | 0.73 | |
XYL | D-XYLITOL | G,H,L | 2B4C | 0.73 | |
XYL | D-XYLITOL | A,B | 1FX5 | 0.73 | |
XYL | D-XYLITOL | A,B | 1XLM | 0.73 | |
XYL | D-XYLITOL | A,B,C,D | 1XIN | 0.73 | |
XYL | D-XYLITOL | A,B,C,D | 2XIM | 0.73 | |
XYL | D-XYLITOL | A | 2VFS | 0.73 | |
XYL | D-XYLITOL | A,B,C,D | 1XIM | 0.73 | |
XYL | D-XYLITOL | A | 2XIS | 0.73 | |
XYL | D-XYLITOL | A,B | 1XLG | 0.73 | |
XYL | D-XYLITOL | A,B | 1XLD | 0.73 | |
XYL | D-XYLITOL | A | 1LTE | 0.73 | |
XYL | D-XYLITOL | A,B | 1XLJ | 0.73 | |
XYL | D-XYLITOL | A | 1XIG | 0.73 | |
XYL | D-XYLITOL | A,B | 5XIA | 0.73 | |
SBT | 2-BUTANOL | A,B,C,D | 1BXZ | 0.71 | |
SBT | 2-BUTANOL | A | 2PLH | 0.71 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2HH1 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWT | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXK | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 1RZH | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2HG3 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX3 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A | 2PIL | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B | 1U19 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2J8D | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B,C,D | 3DTU | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX4 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B | 1HZX | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B | 2G87 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B | 2PED | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | C,H,L,M | 3D38 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWV | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 1RG5 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A | 1KMO | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | C,H,L,M | 1L9B | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWU | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A | 1AY2 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B | 1RP0 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | C,H,L,M | 2I5N | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2J8C | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2HJ6 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXJ | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | L,M | 1YF6 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | B | 2BF3 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B | 2HPY | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UX5 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | L,M,X | 2UXM | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UXL | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B | 1L9H | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A | 2HI2 | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | A,B,D,E,G,H, J,K | 1LGH | 0.76 | |
HTO | HEPTANE-1,2,3-TRIOL | H,L,M | 2UWW | 0.76 | |
RNT | L-RHAMNITOL | A,B,C,D | 1DE5 | 0.85 | |
HEZ | HEXANE-1,6-DIOL | A,B | 1X1V | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B,C,D,E,F | 1M8T | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 1J7K | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 2IOR | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,D | 2NY2 | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 2NY0 | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B,C,D | 3CDO | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B,C,D | 2NXZ | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,D | 2NY4 | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 1P2V | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 1NHZ | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,C,D,E,F,G | 2HY6 | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 2NXY | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B | 2VYP | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B | 1JMT | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 1U3C | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B,C,D | 3G36 | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B,C,D | 3EDC | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 1QUH | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 1IN4 | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B,C,D | 1WXW | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B | 3EV1 | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B,D | 2WIW | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A,B,C,D | 1IBY | 0.82 | |
HEZ | HEXANE-1,6-DIOL | A | 1QUD | 0.82 | |
3HD | 3-O-METHYL-O-ALPHA-D-MANNOPYRANOSYL | A | 2HGO | 0.74 | |
BU2 | 1,3-BUTANEDIOL | A,B | 1LOL | 0.76 | |
BU2 | 1,3-BUTANEDIOL | A,B | 2RFM | 0.76 | |
MTL | D-MANNITOL | A,B | 1ZZU | 0.82 | |
MTL | D-MANNITOL | A,B | 1ZZQ | 0.82 | |
MTL | D-MANNITOL | A,B | 1M2W | 0.82 | |
MTL | D-MANNITOL | A | 2VFU | 0.82 | |
HE2 | HEXAN-1-OL | A | 1ZNE | 0.82 | |
BU3 | (R,R)-2,3-BUTANEDIOL | A,B | 2CL5 | 0.7 | |
BU3 | (R,R)-2,3-BUTANEDIOL | A | 1Z2U | 0.7 | |
BU3 | (R,R)-2,3-BUTANEDIOL | A,B | 1SMH | 0.7 | |
BU3 | (R,R)-2,3-BUTANEDIOL | A | 1XH9 | 0.7 | |
BU3 | (R,R)-2,3-BUTANEDIOL | A,B,C,D,E,F, G,H | 2F9P | 0.7 | |
BU3 | (R,R)-2,3-BUTANEDIOL | A | 2H90 | 0.7 | |
BU3 | (R,R)-2,3-BUTANEDIOL | A,B,C,D,E,F, G,H | 2F9N | 0.7 | |
BU3 | (R,R)-2,3-BUTANEDIOL | A,B | 1XH5 | 0.7 | |
FOC | FUCITOL | A,B,C,D,E,F | 1FUI | 0.85 |