Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02313750
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 |
VME | METHYL L-VALINATE | A,B,C | 2JE4 | 0.82 | |
VME | METHYL L-VALINATE | A,B,C | 2J9J | 0.82 | |
VME | METHYL L-VALINATE | A,B,C | 7HVP | 0.82 | |
0AG | N-(ethoxycarbonyl)-L-leucine | I,J | 1PSA | 0.73 | |
SYM | 2S,4R-4-METHYLGLUTAMATE | A,B | 1SD3 | 0.72 | |
LEF | (4S)-5-FLUORO-L-LEUCINE | A | 1OGW | 0.78 | |
LEP | N-phosphono-L-leucine | E | 2TMN | 0.71 | |
BIU | 5-bromo-L-isoleucine | A | 3EDS | 0.71 | |
LED | (4R)-5-OXO-L-LEUCINE | A | 2IUW | 0.77 | |
2ML | 2-METHYLLEUCINE | A,B,C | 1I1L | 0.72 | |
2ML | 2-METHYLLEUCINE | A | 2RM9 | 0.72 | |
2ML | 2-METHYLLEUCINE | A | 2RMD | 0.72 | |
0AA | methyl L-valinate | I | 1HEF | 0.82 | |
MLE | N-METHYLLEUCINE | A,D | 2J9A | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1IKF | 0.72 | |
MLE | N-METHYLLEUCINE | A,M,N | 2Z6W | 0.72 | |
MLE | N-METHYLLEUCINE | B,D,F,H,J,L, N,P | 1C5F | 0.72 | |
MLE | N-METHYLLEUCINE | D,E,F | 1XQ7 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWA | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWF | 0.72 | |
MLE | N-METHYLLEUCINE | B,D,F,H,J,L, N,P,R,T | 2RMB | 0.72 | |
MLE | N-METHYLLEUCINE | B | 3CYS | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWH | 0.72 | |
MLE | N-METHYLLEUCINE | A,B,C,D,E,F, G,H | 3BO7 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CYN | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1LV9 | 0.72 | |
MLE | N-METHYLLEUCINE | C,D | 2OJU | 0.72 | |
MLE | N-METHYLLEUCINE | B,D,F,H,J,L, N,P,R,T | 2RMA | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1IKM | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWK | 0.72 | |
MLE | N-METHYLLEUCINE | A,B | 2HG8 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWB | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWJ | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1CYB | 0.72 | |
MLE | N-METHYLLEUCINE | D | 1QNG | 0.72 | |
MLE | N-METHYLLEUCINE | B | 1MIK | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1CSA | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWL | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1CYA | 0.72 | |
MLE | N-METHYLLEUCINE | A,B,D | 1MF8 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1BCK | 0.72 | |
MLE | N-METHYLLEUCINE | A,B,D,E,F,H | 1M63 | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWC | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWI | 0.72 | |
MLE | N-METHYLLEUCINE | C,D | 1QNH | 0.72 | |
MLE | N-METHYLLEUCINE | B,D,F,H | 2RMC | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWM | 0.72 | |
MLE | N-METHYLLEUCINE | T,U,V | 2POY | 0.72 | |
MLE | N-METHYLLEUCINE | A,B,C,D,E,F, I,J,K,L,M,N | 2ESL | 0.72 | |
MLE | N-METHYLLEUCINE | C | 1CWO | 0.72 | |
MLE | N-METHYLLEUCINE | A | 1IKL | 0.72 | |
BGT | TERT-BUTYL D-ALPHA-GLUTAMINATE | A,B | 2AFU | 0.73 | |
DIL | D-ISOLEUCINE | A,B | 2Q33 | 0.77 | |
DIL | D-ISOLEUCINE | A | 1CWZ | 0.77 | |
DIL | D-ISOLEUCINE | A | 1CVQ | 0.77 | |
DIL | D-ISOLEUCINE | A | 1C4B | 0.77 | |
DIL | D-ISOLEUCINE | A | 1CW8 | 0.77 | |
DIL | D-ISOLEUCINE | A | 2AP8 | 0.77 | |
DLE | D-LEUCINE | A,B | 1ALZ | 0.81 | |
DLE | D-LEUCINE | A,B | 1BDW | 0.81 | |
DLE | D-LEUCINE | A,D | 1CZQ | 0.81 | |
DLE | D-LEUCINE | A | 1BFW | 0.81 | |
DLE | D-LEUCINE | E,F,G,H | 1XN2 | 0.81 | |
DLE | D-LEUCINE | A,B,C,D | 1GMK | 0.81 | |
DLE | D-LEUCINE | A,B | 1TKQ | 0.81 | |
DLE | D-LEUCINE | A,B,C,H,K,L | 2R5D | 0.81 | |
DLE | D-LEUCINE | A | 2NPV | 0.81 | |
DLE | D-LEUCINE | A,B,C,D | 2R3C | 0.81 | |
DLE | D-LEUCINE | B,D,E | 1AFQ | 0.81 | |
DLE | D-LEUCINE | A,B | 1MIC | 0.81 | |
DLE | D-LEUCINE | A,B | 1NRU | 0.81 | |
DLE | D-LEUCINE | A,B | 1JNO | 0.81 | |
DLE | D-LEUCINE | A,B | 1GRM | 0.81 | |
DLE | D-LEUCINE | A,B | 1NRM | 0.81 | |
DLE | D-LEUCINE | A,D | 2Q3I | 0.81 | |
DLE | D-LEUCINE | A,B | 1NT5 | 0.81 | |
DLE | D-LEUCINE | A | 2JUE | 0.81 | |
DLE | D-LEUCINE | A,B,C,D | 1AV2 | 0.81 | |
DLE | D-LEUCINE | A | 1YY2 | 0.81 | |
DLE | D-LEUCINE | A,B | 1AL4 | 0.81 | |
DLE | D-LEUCINE | A,B | 1NG8 | 0.81 | |
DLE | D-LEUCINE | A,B | 1ALX | 0.81 | |
DLE | D-LEUCINE | A,B | 1JO4 | 0.81 | |
DLE | D-LEUCINE | A,B,C,H,K,L | 2R5B | 0.81 | |
DLE | D-LEUCINE | A,B | 1MAG | 0.81 | |
DLE | D-LEUCINE | A,B | 1NT6 | 0.81 | |
DLE | D-LEUCINE | A,B | 2Q33 | 0.81 | |
DLE | D-LEUCINE | A,B | 1JO3 | 0.81 | |
DLE | D-LEUCINE | E,I | 1BLL | 0.81 | |
DLE | D-LEUCINE | A,B | 1KQE | 0.81 | |
DLE | D-LEUCINE | A,B,C,D | 1W5U | 0.81 | |
DLE | D-LEUCINE | A,B,C,D | 2IZQ | 0.81 | |
DLE | D-LEUCINE | A | 1C4B | 0.81 | |
DLE | D-LEUCINE | A,B,C,D | 1C4D | 0.81 | |
IIL | ISO-ISOLEUCINE | A,B,C,D | 1Q4V | 0.77 | |
IIL | ISO-ISOLEUCINE | A | 1KMF | 0.77 | |
IIL | ISO-ISOLEUCINE | A,B,C | 1TGG | 0.77 | |
IIL | ISO-ISOLEUCINE | A | 1RH4 | 0.77 | |
NLO | O-METHYL-L-NORLEUCINE | A,B | 1S4A | 0.77 | |
NVA | NORVALINE | B,C | 1CA8 | 0.73 | |
NVA | NORVALINE | B,C,D | 1BA8 | 0.73 | |
NVA | NORVALINE | A | 1C9Y | 0.73 | |
NVA | NORVALINE | A,D | 2BTE | 0.73 | |
NVA | NORVALINE | A | 1OBH | 0.73 | |
NVA | NORVALINE | E,S | 1Z3P | 0.73 | |
NVA | NORVALINE | A | 1ZNM | 0.73 | |
NVA | NORVALINE | A | 1JDX | 0.73 | |
NVA | NORVALINE | A | 1FB5 | 0.73 | |
NVA | NORVALINE | A | 1OBC | 0.73 | |
NVA | NORVALINE | 1 | 1YYY | 0.73 | |
NVA | NORVALINE | A,B | 1B6H | 0.73 | |
NVA | NORVALINE | A,B | 1ZZZ | 0.73 | |
NVA | NORVALINE | A,B,C | 2I6U | 0.73 | |
NVA | NORVALINE | B,C | 1BB0 | 0.73 | |
NVA | NORVALINE | E,S | 1Z3M | 0.73 | |
MLL | METHYL L-LEUCINATE | C,F,M,N | 2IAE | 0.92 | |
HLU | BETA-HYDROXYLEUCINE | A | 1ROV | 0.76 | |
DVA | D-VALINE | A,B,C,D | 1C4D | 0.71 | |
DVA | D-VALINE | A,B,C,D | 3BOG | 0.71 | |
DVA | D-VALINE | A,B,C,D | 1GMK | 0.71 | |
DVA | D-VALINE | A | 209D | 0.71 | |
DVA | D-VALINE | A,B | 1TKQ | 0.71 | |
DVA | D-VALINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X | 1UNJ | 0.71 | |
DVA | D-VALINE | A,B | 1MIC | 0.71 | |
DVA | D-VALINE | A,B | 1NRU | 0.71 | |
DVA | D-VALINE | A | 1DSD | 0.71 | |
DVA | D-VALINE | B | 1L1V | 0.71 | |
DVA | D-VALINE | A,B | 1JNO | 0.71 | |
DVA | D-VALINE | A,B | 1NRM | 0.71 | |
DVA | D-VALINE | A,B | 1NT5 | 0.71 | |
DVA | D-VALINE | A | 2JUE | 0.71 | |
DVA | D-VALINE | A,B,C,D | 1AV2 | 0.71 | |
DVA | D-VALINE | A,B | 2FCN | 0.71 | |
DVA | D-VALINE | A,B | 1A7Z | 0.71 | |
DVA | D-VALINE | A,B | 1AL4 | 0.71 | |
DVA | D-VALINE | A,B | 1NG8 | 0.71 | |
DVA | D-VALINE | A | 2D55 | 0.71 | |
DVA | D-VALINE | A | 1DSC | 0.71 | |
DVA | D-VALINE | A,B | 1ALX | 0.71 | |
DVA | D-VALINE | A,B | 1JO4 | 0.71 | |
DVA | D-VALINE | A,B | 1MAG | 0.71 | |
DVA | D-VALINE | A,B | 1NT6 | 0.71 | |
DVA | D-VALINE | A,B | 2Q33 | 0.71 | |
DVA | D-VALINE | A,B | 1JO3 | 0.71 | |
DVA | D-VALINE | C,D | 1MNV | 0.71 | |
DVA | D-VALINE | A,B | 1KQE | 0.71 | |
DVA | D-VALINE | A,B,C,D | 1W5U | 0.71 | |
DVA | D-VALINE | A,B,C,D | 2IZQ | 0.71 | |
DVA | D-VALINE | A,B,C,D,E,F | 1UNM | 0.71 | |
DVA | D-VALINE | A,C,D | 1S4V | 0.71 | |
DVA | D-VALINE | A,B | 1OVF | 0.71 | |
DVA | D-VALINE | A,L | 1ZEA | 0.71 | |
DVA | D-VALINE | A,B | 1ALZ | 0.71 | |
DVA | D-VALINE | A,B,C | 1A7Y | 0.71 | |
DVA | D-VALINE | A,B | 173D | 0.71 | |
DVA | D-VALINE | A,B | 1BDW | 0.71 | |
DVA | D-VALINE | A,B | 1FJA | 0.71 | |
DVA | D-VALINE | A | 1BFW | 0.71 | |
DVA | D-VALINE | A,B,C,D | 1I3W | 0.71 | |
DVA | D-VALINE | A | 316D | 0.71 | |
DVA | D-VALINE | A,B,C | 1QFI | 0.71 | |
DVA | D-VALINE | A,B | 1GRM | 0.71 |