Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03266940
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 |
MKE | (4S)-4-AMINO-5-OXOHEXANOIC ACID | A,I | 2HAL | 0.71 | |
BIL | (3R,4S)-3-amino-4-methylhexanoic acid | A,B,C | 3HEZ | 0.78 | |
BIL | (3R,4S)-3-amino-4-methylhexanoic acid | A,B,C,D | 3C3F | 0.78 | |
BIL | (3R,4S)-3-amino-4-methylhexanoic acid | A | 3HF0 | 0.78 | |
BIL | (3R,4S)-3-amino-4-methylhexanoic acid | A | 3C3G | 0.78 | |
MN1 | 4-CARBOXYPIPERIDINE | N | 1NLO | 0.72 | |
MN1 | 4-CARBOXYPIPERIDINE | N | 1NLP | 0.72 | |
DOA | 12-AMINO-DODECANOIC ACID | B | 1EOJ | 0.73 | |
DOA | 12-AMINO-DODECANOIC ACID | A,D | 1H8T | 0.73 | |
DOA | 12-AMINO-DODECANOIC ACID | A | 2DCX | 0.73 | |
DOA | 12-AMINO-DODECANOIC ACID | B | 1EOL | 0.73 | |
AMH | TRANS-4-AMINOMETHYLCYCLOHEXANE- 1-CARBOXYLIC ACID | A,B | 1CEB | 0.77 | |
AMH | TRANS-4-AMINOMETHYLCYCLOHEXANE- 1-CARBOXYLIC ACID | A | 1B2I | 0.77 | |
NPI | 2-AMINOPIMELIC ACID | A | 2TDT | 0.7 | |
NPI | 2-AMINOPIMELIC ACID | A | 1KGQ | 0.7 | |
GBN | [1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID | A,B | 2COJ | 0.72 | |
GBN | [1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID | A,B,C | 2EJ3 | 0.72 | |
GBN | [1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID | A,B | 2A1H | 0.72 | |
GBN | [1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID | A,B | 2COI | 0.72 | |
B3Q | (3S)-3,6-diamino-6-oxohexanoic acid | A,B,C | 3HEZ | 0.73 | |
B3Q | (3S)-3,6-diamino-6-oxohexanoic acid | A | 3C3G | 0.73 | |
AB5 | 2(S)-AMINO-6-BORONOHEXANOIC ACID | A,B | 2AEB | 0.73 | |
VIG | 4-AMINO HEXANOIC ACID | A,B,C,D | 1OHW | 0.79 | |
ABH | 2(S)-AMINO-6-BORONOHEXANOIC ACID | A,B | 1D3V | 0.74 | |
ABH | 2(S)-AMINO-6-BORONOHEXANOIC ACID | A,B | 2PLL | 0.74 | |
ABH | 2(S)-AMINO-6-BORONOHEXANOIC ACID | A,B | 3E6K | 0.74 | |
ABH | 2(S)-AMINO-6-BORONOHEXANOIC ACID | A,B | 3E6V | 0.74 | |
IKT | 3-(1-AMINOETHYL)NONANEDIOIC ACID | A | 1DAE | 0.75 | |
DLE | D-LEUCINE | A,B | 1ALZ | 0.71 | |
DLE | D-LEUCINE | A,B | 1BDW | 0.71 | |
DLE | D-LEUCINE | A,D | 1CZQ | 0.71 | |
DLE | D-LEUCINE | A | 1BFW | 0.71 | |
DLE | D-LEUCINE | E,F,G,H | 1XN2 | 0.71 | |
DLE | D-LEUCINE | A,B,C,D | 1GMK | 0.71 | |
DLE | D-LEUCINE | A,B | 1TKQ | 0.71 | |
DLE | D-LEUCINE | A,B,C,H,K,L | 2R5D | 0.71 | |
DLE | D-LEUCINE | A | 2NPV | 0.71 | |
DLE | D-LEUCINE | A,B,C,D | 2R3C | 0.71 | |
DLE | D-LEUCINE | B,D,E | 1AFQ | 0.71 | |
DLE | D-LEUCINE | A,B | 1MIC | 0.71 | |
DLE | D-LEUCINE | A,B | 1NRU | 0.71 | |
DLE | D-LEUCINE | A,B | 1JNO | 0.71 | |
DLE | D-LEUCINE | A,B | 1GRM | 0.71 | |
DLE | D-LEUCINE | A,B | 1NRM | 0.71 | |
DLE | D-LEUCINE | A,D | 2Q3I | 0.71 | |
DLE | D-LEUCINE | A,B | 1NT5 | 0.71 | |
DLE | D-LEUCINE | A | 2JUE | 0.71 | |
DLE | D-LEUCINE | A,B,C,D | 1AV2 | 0.71 | |
DLE | D-LEUCINE | A | 1YY2 | 0.71 | |
DLE | D-LEUCINE | A,B | 1AL4 | 0.71 | |
DLE | D-LEUCINE | A,B | 1NG8 | 0.71 | |
DLE | D-LEUCINE | A,B | 1ALX | 0.71 | |
DLE | D-LEUCINE | A,B | 1JO4 | 0.71 | |
DLE | D-LEUCINE | A,B,C,H,K,L | 2R5B | 0.71 | |
DLE | D-LEUCINE | A,B | 1MAG | 0.71 | |
DLE | D-LEUCINE | A,B | 1NT6 | 0.71 | |
DLE | D-LEUCINE | A,B | 2Q33 | 0.71 | |
DLE | D-LEUCINE | A,B | 1JO3 | 0.71 | |
DLE | D-LEUCINE | E,I | 1BLL | 0.71 | |
DLE | D-LEUCINE | A,B | 1KQE | 0.71 | |
DLE | D-LEUCINE | A,B,C,D | 1W5U | 0.71 | |
DLE | D-LEUCINE | A,B,C,D | 2IZQ | 0.71 | |
DLE | D-LEUCINE | A | 1C4B | 0.71 | |
DLE | D-LEUCINE | A,B,C,D | 1C4D | 0.71 | |
LME | (3R)-3-METHYL-L-GLUTAMIC ACID | A | 1XT7 | 0.72 | |
NLE | NORLEUCINE | A | 1MMT | 0.74 | |
NLE | NORLEUCINE | A,B | 1JB6 | 0.74 | |
NLE | NORLEUCINE | C | 1K2B | 0.74 | |
NLE | NORLEUCINE | A,B,C | 2AVQ | 0.74 | |
NLE | NORLEUCINE | C,D,I,L | 1R1L | 0.74 | |
NLE | NORLEUCINE | E,S | 2RLN | 0.74 | |
NLE | NORLEUCINE | E,S | 1Z3L | 0.74 | |
NLE | NORLEUCINE | A,B,C | 2AOD | 0.74 | |
NLE | NORLEUCINE | A,B,C | 2J9J | 0.74 | |
NLE | NORLEUCINE | A,B,I | 4HVP | 0.74 | |
NLE | NORLEUCINE | A,B,C | 2AVM | 0.74 | |
NLE | NORLEUCINE | B,C | 1K1T | 0.74 | |
NLE | NORLEUCINE | A,B,C | 2AOC | 0.74 | |
NLE | NORLEUCINE | A,B,C | 2JE4 | 0.74 | |
NLE | NORLEUCINE | A,B,I | 3DCK | 0.74 | |
NLE | NORLEUCINE | B | 1EOL | 0.74 | |
NLE | NORLEUCINE | A | 1FF0 | 0.74 | |
NLE | NORLEUCINE | A | 1FG6 | 0.74 | |
NLE | NORLEUCINE | A | 1FGC | 0.74 | |
NLE | NORLEUCINE | E,S | 1Z3M | 0.74 | |
NLE | NORLEUCINE | A | 2RME | 0.74 | |
NLE | NORLEUCINE | B | 1FGL | 0.74 | |
NLE | NORLEUCINE | C | 1K1U | 0.74 | |
NLE | NORLEUCINE | A,B | 1B7H | 0.74 | |
NLE | NORLEUCINE | A | 1HTH | 0.74 | |
NLE | NORLEUCINE | A,B,D | 2J9K | 0.74 | |
NLE | NORLEUCINE | A | 2RMD | 0.74 | |
NLE | NORLEUCINE | A,B,C | 2AOG | 0.74 | |
NLE | NORLEUCINE | A | 2RMI | 0.74 | |
NLE | NORLEUCINE | I | 1EPO | 0.74 | |
NLE | NORLEUCINE | A | 1FFI | 0.74 | |
NLE | NORLEUCINE | A | 1HD9 | 0.74 | |
NLE | NORLEUCINE | A | 1FFF | 0.74 | |
NLE | NORLEUCINE | B | 2JND | 0.74 | |
NLE | NORLEUCINE | A | 1FEJ | 0.74 | |
NLE | NORLEUCINE | A | 2K9E | 0.74 | |
NLE | NORLEUCINE | C | 1CFN | 0.74 | |
NLE | NORLEUCINE | C | 1K2C | 0.74 | |
NLE | NORLEUCINE | A | 1WY4 | 0.74 | |
NLE | NORLEUCINE | A | 1FQ8 | 0.74 | |
NLE | NORLEUCINE | A,B | 1S1O | 0.74 | |
NLE | NORLEUCINE | A | 2F4K | 0.74 | |
NLE | NORLEUCINE | A,B | 1D5E | 0.74 | |
NLE | NORLEUCINE | A | 2JX4 | 0.74 | |
NLE | NORLEUCINE | A | 1FG8 | 0.74 | |
NLE | NORLEUCINE | A | 1WY3 | 0.74 | |
NLE | NORLEUCINE | I | 1YTJ | 0.74 | |
NLE | NORLEUCINE | A,B,I | 3DCR | 0.74 | |
NLE | NORLEUCINE | A,I | 2O40 | 0.74 | |
NLE | NORLEUCINE | A,B | 2GYP | 0.74 | |
NLE | NORLEUCINE | C,F | 1A8K | 0.74 | |
NLE | NORLEUCINE | C | 1BAI | 0.74 | |
NLE | NORLEUCINE | A,B | 2JT9 | 0.74 | |
NLE | NORLEUCINE | A | 2RM9 | 0.74 | |
NLE | NORLEUCINE | A,B | 1DAZ | 0.74 | |
NLE | NORLEUCINE | A | 1F3R | 0.74 | |
NLE | NORLEUCINE | A,I | 2JXR | 0.74 | |
NLE | NORLEUCINE | C,F | 1A94 | 0.74 | |
NLE | NORLEUCINE | A,B | 1S4A | 0.74 | |
NLE | NORLEUCINE | A | 1R9V | 0.74 | |
NLE | NORLEUCINE | A,B,C,D,E,F | 2Z2T | 0.74 | |
AHP | 2-AMINO-HEPTANOIC ACID | D | 1J4X | 0.7 | |
DAV | DELTA-AMINO VALERIC ACID | A | 1H7O | 0.73 | |
DAV | DELTA-AMINO VALERIC ACID | A | 7JDW | 0.73 | |
DLY | D-LYSINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1YWH | 0.74 | |
DLY | D-LYSINE | A | 1C4B | 0.74 | |
DLY | D-LYSINE | A,B,C,D | 3BOG | 0.74 | |
DLY | D-LYSINE | A | 1KO0 | 0.74 | |
DLY | D-LYSINE | A,B,C,D | 3C1P | 0.74 | |
DLY | D-LYSINE | A,B,C,H,K,L | 2R5D | 0.74 | |
DLY | D-LYSINE | A,B,C,D | 2R3C | 0.74 | |
DLY | D-LYSINE | A,B,C,H,K,L | 2R5B | 0.74 | |
DLY | D-LYSINE | A,B | 2Q33 | 0.74 | |
DLY | D-LYSINE | A,B | 2ATS | 0.74 | |
DLY | D-LYSINE | A | 1RCQ | 0.74 | |
HOZ | (4S)-4,5-DIAMINOPENTANOIC ACID | A,B | 2HOZ | 0.71 | |
HOZ | (4S)-4,5-DIAMINOPENTANOIC ACID | A,B | 2HP2 | 0.71 | |
HOZ | (4S)-4,5-DIAMINOPENTANOIC ACID | A,B | 2HP1 | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | E,I,J | 1M1A | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | D,I,J | 1M18 | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | A | 2OKK | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | I | 1QUR | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | E,I,J | 1M19 | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | A,B | 2OKJ | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | A,B | 1CGL | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | A | 6JDW | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | A,D,E,G,I,J | 1S32 | 0.71 | |
ABU | GAMMA-AMINO-BUTANOIC ACID | A,B | 2JT9 | 0.71 | |
ZAL | 3-cyclohexyl-D-alanine | I | 1HBT | 0.71 | |
XCP | (1S,2S)-2-aminocyclopentanecarboxylic acid | A | 3HF0 | 0.79 | |
XCP | (1S,2S)-2-aminocyclopentanecarboxylic acid | A,B,D,E,F | 3FDM | 0.79 | |
XCP | (1S,2S)-2-aminocyclopentanecarboxylic acid | A | 3C3H | 0.79 | |
B3E | (3S)-3-AMINOHEXANEDIOIC ACID | A | 3C3G | 0.76 | |
B3E | (3S)-3-AMINOHEXANEDIOIC ACID | A | 2OXK | 0.76 | |
B3E | (3S)-3-AMINOHEXANEDIOIC ACID | A,B,C,D | 3C3F | 0.76 | |
B3E | (3S)-3-AMINOHEXANEDIOIC ACID | A,B,C | 3HEZ | 0.76 | |
B3E | (3S)-3-AMINOHEXANEDIOIC ACID | A,B,C | 2OXJ | 0.76 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A | 3C3H | 0.75 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A | 3C3G | 0.75 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A,B,C,D | 3C3F | 0.75 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A,B,C | 3HEZ | 0.75 | |
B3L | (3S)-3-amino-5-methylhexanoic acid | A,B,D,E,F | 3FDM | 0.75 | |
MEG | (2S,3R)-3-METHYL-GLUTAMIC ACID | A | 1T5N | 0.72 | |
MEG | (2S,3R)-3-METHYL-GLUTAMIC ACID | A | 1T5M | 0.72 | |
DIL | D-ISOLEUCINE | A,B | 2Q33 | 0.74 | |
DIL | D-ISOLEUCINE | A | 1CWZ | 0.74 | |
DIL | D-ISOLEUCINE | A | 1CVQ | 0.74 | |
DIL | D-ISOLEUCINE | A | 1C4B | 0.74 | |
DIL | D-ISOLEUCINE | A | 1CW8 | 0.74 | |
DIL | D-ISOLEUCINE | A | 2AP8 | 0.74 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D | 1D5Z | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | H,I | 5GDS | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | H,P | 2A2X | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D,H | 2FEQ | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | H,P | 2ANK | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,C,D | 3DPP | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A | 1EB1 | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D,H | 1NZQ | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | I | 1HBT | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D | 1D6E | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,B | 1B3H | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D,H | 2FES | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | C,D,E,G,H | 3DPQ | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | I | 1THS | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | I | 1QUR | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,B,C,D | 3DPO | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | H,I | 4THN | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,D | 1D5M | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D,H | 1O0D | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1YWH | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | A | 1XRZ | 0.71 | |
ALC | 2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID | D | 1D5X | 0.71 | |
IIL | ISO-ISOLEUCINE | A,B,C,D | 1Q4V | 0.74 | |
IIL | ISO-ISOLEUCINE | A | 1KMF | 0.74 | |
IIL | ISO-ISOLEUCINE | A,B,C | 1TGG | 0.74 | |
IIL | ISO-ISOLEUCINE | A | 1RH4 | 0.74 | |
PB1 | 3-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACID | A,B | 1PV8 | 0.75 | |
DNE | D-NORLEUCINE | A | 1R9V | 0.74 | |
DNE | D-NORLEUCINE | A,B | 1S4A | 0.74 | |
DNE | D-NORLEUCINE | A,B | 1S1O | 0.74 | |
CHG | CYCLOHEXYL-GLYCINE | 2,3,4 | 8KME | 0.72 | |
CHG | CYCLOHEXYL-GLYCINE | H,I | 4THN | 0.72 | |
CHG | CYCLOHEXYL-GLYCINE | H,I,J | 7KME | 0.72 | |
CHG | CYCLOHEXYL-GLYCINE | H,I | 5GDS | 0.72 | |
AC5 | 1-AMINOCYCLOPENTANECARBOXYLIC ACID | A,B | 1Y1M | 0.71 | |
ACA | 6-AMINOHEXANOIC ACID | A,B | 2JT9 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A,B | 1CEA | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | C | 1ILP | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 2PK4 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 1,2,4,5,A,B, C,D,E,J,K,L, M,N,O,P,R,S, T,U,V,Z | 1M90 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 0,1,3,4,5,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ6 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 0,2,4,9,A,B, C,H,I,J,K,L, M,N,P,Q,R,S, T,X,Y,Z | 1KQS | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 1PK2 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 2ZM7 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 0,1,2,3,6,9, A,B,C,D,F,H, J,K,L,M,N,O, Q,R,S,T,U,Y,Z | 3CMA | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | C | 1ILQ | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 2ZM8 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 1VQK | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 2DCF | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 1HPK | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 1VQ8 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 0,1,2,3,6,9, A,B,C,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 3CME | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 2ZM9 | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 0,1,2,3,4,5, 9,A,B,C,D,F, H,J,K,L,M,N, O,Q,R,S,T,U, Y,Z | 1VQN | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 2ZMA | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | A | 3KIV | 0.82 | |
ACA | 6-AMINOHEXANOIC ACID | 0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 1VQ9 | 0.82 |