Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03373576
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 |
DFI | 2,2-DIFLUOROSTATINE | E,I | 1APW | 0.71 | |
AHH | AMINO-HYDROXYHEPTANOIC ACID | A,I | 3MAT | 0.86 | |
XCP | (1S,2S)-2-aminocyclopentanecarboxylic acid | A | 3HF0 | 0.75 | |
XCP | (1S,2S)-2-aminocyclopentanecarboxylic acid | A,B,D,E,F | 3FDM | 0.75 | |
XCP | (1S,2S)-2-aminocyclopentanecarboxylic acid | A | 3C3H | 0.75 | |
DDO | 6-HYDROXY-D-NORLEUCINE | A,B,C,D | 1JSL | 0.71 | |
HLU | BETA-HYDROXYLEUCINE | A | 1ROV | 0.78 | |
LYZ | 5-HYDROXYLYSINE | A,B,C,D | 1QGW | 0.7 | |
LYZ | 5-HYDROXYLYSINE | A,B,C,D | 1XG0 | 0.7 | |
LYZ | 5-HYDROXYLYSINE | A,B,C,D | 1XF6 | 0.7 | |
LYZ | 5-HYDROXYLYSINE | A,B,C | 1YGV | 0.7 | |
LYZ | 5-HYDROXYLYSINE | A,B,C | 1Y0F | 0.7 | |
DLE | D-LEUCINE | A,B | 1ALZ | 0.73 | |
DLE | D-LEUCINE | A,B | 1BDW | 0.73 | |
DLE | D-LEUCINE | A,D | 1CZQ | 0.73 | |
DLE | D-LEUCINE | A | 1BFW | 0.73 | |
DLE | D-LEUCINE | E,F,G,H | 1XN2 | 0.73 | |
DLE | D-LEUCINE | A,B,C,D | 1GMK | 0.73 | |
DLE | D-LEUCINE | A,B | 1TKQ | 0.73 | |
DLE | D-LEUCINE | A,B,C,H,K,L | 2R5D | 0.73 | |
DLE | D-LEUCINE | A | 2NPV | 0.73 | |
DLE | D-LEUCINE | A,B,C,D | 2R3C | 0.73 | |
DLE | D-LEUCINE | B,D,E | 1AFQ | 0.73 | |
DLE | D-LEUCINE | A,B | 1MIC | 0.73 | |
DLE | D-LEUCINE | A,B | 1NRU | 0.73 | |
DLE | D-LEUCINE | A,B | 1JNO | 0.73 | |
DLE | D-LEUCINE | A,B | 1GRM | 0.73 | |
DLE | D-LEUCINE | A,B | 1NRM | 0.73 | |
DLE | D-LEUCINE | A,D | 2Q3I | 0.73 | |
DLE | D-LEUCINE | A,B | 1NT5 | 0.73 | |
DLE | D-LEUCINE | A | 2JUE | 0.73 | |
DLE | D-LEUCINE | A,B,C,D | 1AV2 | 0.73 | |
DLE | D-LEUCINE | A | 1YY2 | 0.73 | |
DLE | D-LEUCINE | A,B | 1AL4 | 0.73 | |
DLE | D-LEUCINE | A,B | 1NG8 | 0.73 | |
DLE | D-LEUCINE | A,B | 1ALX | 0.73 | |
DLE | D-LEUCINE | A,B | 1JO4 | 0.73 | |
DLE | D-LEUCINE | A,B,C,H,K,L | 2R5B | 0.73 | |
DLE | D-LEUCINE | A,B | 1MAG | 0.73 | |
DLE | D-LEUCINE | A,B | 1NT6 | 0.73 | |
DLE | D-LEUCINE | A,B | 2Q33 | 0.73 | |
DLE | D-LEUCINE | A,B | 1JO3 | 0.73 | |
DLE | D-LEUCINE | E,I | 1BLL | 0.73 | |
DLE | D-LEUCINE | A,B | 1KQE | 0.73 | |
DLE | D-LEUCINE | A,B,C,D | 1W5U | 0.73 | |
DLE | D-LEUCINE | A,B,C,D | 2IZQ | 0.73 | |
DLE | D-LEUCINE | A | 1C4B | 0.73 | |
DLE | D-LEUCINE | A,B,C,D | 1C4D | 0.73 | |
AHY | (2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACID | A,D | 2J9A | 0.82 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A | 3C3H | 0.83 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A | 3C3G | 0.83 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A,B,C,D | 3C3F | 0.83 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A,B,C | 3HEZ | 0.83 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A,B,D,E,F | 3FDM | 0.83 | |
NOR | CYCLOHEXYL-NORSTATINE | E,I | 1EPN | 0.82 | |
NOR | CYCLOHEXYL-NORSTATINE | P | 1CZI | 0.82 | |
NOR | CYCLOHEXYL-NORSTATINE | A,I | 1GVT | 0.82 | |
LPL | LEU-HYDROXYETHYLENE-LEU | B,D,F,H | 1SMR | 0.72 | |
42B | 4-AMINO-2-HYDROXYBUTANOIC ACID | B | 1O9M | 0.7 | |
LDO | 6-HYDROXY-L-NORLEUCINE | A,B,C,D | 1JSR | 0.71 | |
LED | (4R)-5-OXO-L-LEUCINE | A | 2IUW | 0.71 | |
LEF | (4S)-5-FLUORO-L-LEUCINE | A | 1OGW | 0.71 | |
DNE | D-NORLEUCINE | A | 1R9V | 0.7 | |
DNE | D-NORLEUCINE | A,B | 1S4A | 0.7 | |
DNE | D-NORLEUCINE | A,B | 1S1O | 0.7 | |
DIL | D-ISOLEUCINE | A,B | 2Q33 | 0.7 | |
DIL | D-ISOLEUCINE | A | 1CWZ | 0.7 | |
DIL | D-ISOLEUCINE | A | 1CVQ | 0.7 | |
DIL | D-ISOLEUCINE | A | 1C4B | 0.7 | |
DIL | D-ISOLEUCINE | A | 1CW8 | 0.7 | |
DIL | D-ISOLEUCINE | A | 2AP8 | 0.7 | |
IIL | ISO-ISOLEUCINE | A,B,C,D | 1Q4V | 0.7 | |
IIL | ISO-ISOLEUCINE | A | 1KMF | 0.7 | |
IIL | ISO-ISOLEUCINE | A,B,C | 1TGG | 0.7 | |
IIL | ISO-ISOLEUCINE | A | 1RH4 | 0.7 | |
STA | STATINE | E | 1EPP | 0.74 | |
STA | STATINE | I | 1XN3 | 0.74 | |
STA | STATINE | A,B,I,J | 2FIV | 0.74 | |
STA | STATINE | A,B,C,D | 1QS8 | 0.74 | |
STA | STATINE | A,B | 2RMP | 0.74 | |
STA | STATINE | E,I | 1APU | 0.74 | |
STA | STATINE | A,I | 1GVU | 0.74 | |
STA | STATINE | I | 3ER5 | 0.74 | |
STA | STATINE | I | 2ER9 | 0.74 | |
STA | STATINE | E,I | 4ER2 | 0.74 | |
STA | STATINE | A,C,I,J,K | 2B7F | 0.74 | |
STA | STATINE | A,B,C | 5HVP | 0.74 | |
STA | STATINE | A,I | 1GVV | 0.74 | |
STA | STATINE | A,I | 1WKR | 0.74 | |
STA | STATINE | I | 5APR | 0.74 | |
STA | STATINE | I | 1PSO | 0.74 | |
STA | STATINE | I | 6APR | 0.74 | |
STA | STATINE | A | 1FQ5 | 0.74 | |
STA | STATINE | A,I | 3FNT | 0.74 | |
STA | STATINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 3FV3 | 0.74 | |
STA | STATINE | A,B,C,D,I,J | 1LYB | 0.74 | |
STA | STATINE | B | 1FIV | 0.74 | |
STA | STATINE | I | 4APR | 0.74 | |
EKE | (4S,5R)-4-AMINO-5-HYDROXYHEXANOIC ACID | A,I | 2HAL | 0.74 | |
BIL | (3R,4S)-3-amino-4-methylhexanoic acid | A,B,C | 3HEZ | 0.8 | |
BIL | (3R,4S)-3-amino-4-methylhexanoic acid | A,B,C,D | 3C3F | 0.8 | |
BIL | (3R,4S)-3-amino-4-methylhexanoic acid | A | 3HF0 | 0.8 | |
BIL | (3R,4S)-3-amino-4-methylhexanoic acid | A | 3C3G | 0.8 | |
NLE | NORLEUCINE | A | 1MMT | 0.7 | |
NLE | NORLEUCINE | A,B | 1JB6 | 0.7 | |
NLE | NORLEUCINE | C | 1K2B | 0.7 | |
NLE | NORLEUCINE | A,B,C | 2AVQ | 0.7 | |
NLE | NORLEUCINE | C,D,I,L | 1R1L | 0.7 | |
NLE | NORLEUCINE | E,S | 2RLN | 0.7 | |
NLE | NORLEUCINE | E,S | 1Z3L | 0.7 | |
NLE | NORLEUCINE | A,B,C | 2AOD | 0.7 | |
NLE | NORLEUCINE | A,B,C | 2J9J | 0.7 | |
NLE | NORLEUCINE | A,B,I | 4HVP | 0.7 | |
NLE | NORLEUCINE | A,B,C | 2AVM | 0.7 | |
NLE | NORLEUCINE | B,C | 1K1T | 0.7 | |
NLE | NORLEUCINE | A,B,C | 2AOC | 0.7 | |
NLE | NORLEUCINE | A,B,C | 2JE4 | 0.7 | |
NLE | NORLEUCINE | A,B,I | 3DCK | 0.7 | |
NLE | NORLEUCINE | B | 1EOL | 0.7 | |
NLE | NORLEUCINE | A | 1FF0 | 0.7 | |
NLE | NORLEUCINE | A | 1FG6 | 0.7 | |
NLE | NORLEUCINE | A | 1FGC | 0.7 | |
NLE | NORLEUCINE | E,S | 1Z3M | 0.7 | |
NLE | NORLEUCINE | A | 2RME | 0.7 | |
NLE | NORLEUCINE | B | 1FGL | 0.7 | |
NLE | NORLEUCINE | C | 1K1U | 0.7 | |
NLE | NORLEUCINE | A,B | 1B7H | 0.7 | |
NLE | NORLEUCINE | A | 1HTH | 0.7 | |
NLE | NORLEUCINE | A,B,D | 2J9K | 0.7 | |
NLE | NORLEUCINE | A | 2RMD | 0.7 | |
NLE | NORLEUCINE | A,B,C | 2AOG | 0.7 | |
NLE | NORLEUCINE | A | 2RMI | 0.7 | |
NLE | NORLEUCINE | I | 1EPO | 0.7 | |
NLE | NORLEUCINE | A | 1FFI | 0.7 | |
NLE | NORLEUCINE | A | 1HD9 | 0.7 | |
NLE | NORLEUCINE | A | 1FFF | 0.7 | |
NLE | NORLEUCINE | B | 2JND | 0.7 | |
NLE | NORLEUCINE | A | 1FEJ | 0.7 | |
NLE | NORLEUCINE | A | 2K9E | 0.7 | |
NLE | NORLEUCINE | C | 1CFN | 0.7 | |
NLE | NORLEUCINE | C | 1K2C | 0.7 | |
NLE | NORLEUCINE | A | 1WY4 | 0.7 | |
NLE | NORLEUCINE | A | 1FQ8 | 0.7 | |
NLE | NORLEUCINE | A,B | 1S1O | 0.7 | |
NLE | NORLEUCINE | A | 2F4K | 0.7 | |
NLE | NORLEUCINE | A,B | 1D5E | 0.7 | |
NLE | NORLEUCINE | A | 2JX4 | 0.7 | |
NLE | NORLEUCINE | A | 1FG8 | 0.7 | |
NLE | NORLEUCINE | A | 1WY3 | 0.7 | |
NLE | NORLEUCINE | I | 1YTJ | 0.7 | |
NLE | NORLEUCINE | A,B,I | 3DCR | 0.7 | |
NLE | NORLEUCINE | A,I | 2O40 | 0.7 | |
NLE | NORLEUCINE | A,B | 2GYP | 0.7 | |
NLE | NORLEUCINE | C,F | 1A8K | 0.7 | |
NLE | NORLEUCINE | C | 1BAI | 0.7 | |
NLE | NORLEUCINE | A,B | 2JT9 | 0.7 | |
NLE | NORLEUCINE | A | 2RM9 | 0.7 | |
NLE | NORLEUCINE | A,B | 1DAZ | 0.7 | |
NLE | NORLEUCINE | A | 1F3R | 0.7 | |
NLE | NORLEUCINE | A,I | 2JXR | 0.7 | |
NLE | NORLEUCINE | C,F | 1A94 | 0.7 | |
NLE | NORLEUCINE | A,B | 1S4A | 0.7 | |
NLE | NORLEUCINE | A | 1R9V | 0.7 | |
NLE | NORLEUCINE | A,B,C,D,E,F | 2Z2T | 0.7 | |
ILX | 4,5-DIHYDROXYISOLEUCINE | A,B,C,I,J,L,M | 3CQZ | 0.76 | |
ILX | 4,5-DIHYDROXYISOLEUCINE | A,B,C,I,J,L,M | 1K83 | 0.76 | |
ILX | 4,5-DIHYDROXYISOLEUCINE | A,B,C,I,J,L, M,T | 2VUM | 0.76 | |
KAH | 5-AMINO-4-HYDROXYHEXANOIC ACID | A | 1H7P | 0.73 |