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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03034199

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DHH(S)-2-AMINO-7,7-DIHYDROXYHEPTANOIC ACIDA,B,C1T5F0.84
LYZ5-HYDROXYLYSINEA,B,C,D1QGW0.75
LYZ5-HYDROXYLYSINEA,B,C,D1XG00.75
LYZ5-HYDROXYLYSINEA,B,C,D1XF60.75
LYZ5-HYDROXYLYSINEA,B,C1YGV0.75
LYZ5-HYDROXYLYSINEA,B,C1Y0F0.75
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.75
EKE(4S,5R)-4-AMINO-5-HYDROXYHEXANOIC ACIDA,I2HAL0.71
UN12-AMINOHEXANEDIOIC ACIDA,B,C,D1H0G0.77
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.83
AHHAMINO-HYDROXYHEPTANOIC ACIDA,I3MAT0.89
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B1QJ30.73
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B,C,D3FMI0.73
KAP7-KETO-8-AMINOPELARGONIC ACIDA,B3DU40.73
EXY6-[(2R)-oxiran-2-yl]-L-norleucineA,B3DJ80.8
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EKM0.71
ZDR(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKJ0.71
LPLLEU-HYDROXYETHYLENE-LEUB,D,F,H1SMR0.72
DA3A,B3DAP0.7
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.71
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.71
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.71
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.71
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.71
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.82
LTA4,8-DIAMINO-3-HYDROXY-OCTANOIC ACID ETHYL ESTERE,I1APT0.72
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA,B,C,D,E,F3EJX0.71
ZDP(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACIDA2GKE0.71
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.78
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.76
NLENORLEUCINEA1MMT0.73
NLENORLEUCINEA,B1JB60.73
NLENORLEUCINEC1K2B0.73
NLENORLEUCINEA,B,C2AVQ0.73
NLENORLEUCINEC,D,I,L1R1L0.73
NLENORLEUCINEE,S2RLN0.73
NLENORLEUCINEE,S1Z3L0.73
NLENORLEUCINEA,B,C2AOD0.73
NLENORLEUCINEA,B,C2J9J0.73
NLENORLEUCINEA,B,I4HVP0.73
NLENORLEUCINEA,B,C2AVM0.73
NLENORLEUCINEB,C1K1T0.73
NLENORLEUCINEA,B,C2AOC0.73
NLENORLEUCINEA,B,C2JE40.73
NLENORLEUCINEA,B,I3DCK0.73
NLENORLEUCINEB1EOL0.73
NLENORLEUCINEA1FF00.73
NLENORLEUCINEA1FG60.73
NLENORLEUCINEA1FGC0.73
NLENORLEUCINEE,S1Z3M0.73
NLENORLEUCINEA2RME0.73
NLENORLEUCINEB1FGL0.73
NLENORLEUCINEC1K1U0.73
NLENORLEUCINEA,B1B7H0.73
NLENORLEUCINEA1HTH0.73
NLENORLEUCINEA,B,D2J9K0.73
NLENORLEUCINEA2RMD0.73
NLENORLEUCINEA,B,C2AOG0.73
NLENORLEUCINEA2RMI0.73
NLENORLEUCINEI1EPO0.73
NLENORLEUCINEA1FFI0.73
NLENORLEUCINEA1HD90.73
NLENORLEUCINEA1FFF0.73
NLENORLEUCINEB2JND0.73
NLENORLEUCINEA1FEJ0.73
NLENORLEUCINEA2K9E0.73
NLENORLEUCINEC1CFN0.73
NLENORLEUCINEC1K2C0.73
NLENORLEUCINEA1WY40.73
NLENORLEUCINEA1FQ80.73
NLENORLEUCINEA,B1S1O0.73
NLENORLEUCINEA2F4K0.73
NLENORLEUCINEA,B1D5E0.73
NLENORLEUCINEA2JX40.73
NLENORLEUCINEA1FG80.73
NLENORLEUCINEA1WY30.73
NLENORLEUCINEI1YTJ0.73
NLENORLEUCINEA,B,I3DCR0.73
NLENORLEUCINEA,I2O400.73
NLENORLEUCINEA,B2GYP0.73
NLENORLEUCINEC,F1A8K0.73
NLENORLEUCINEC1BAI0.73
NLENORLEUCINEA,B2JT90.73
NLENORLEUCINEA2RM90.73
NLENORLEUCINEA,B1DAZ0.73
NLENORLEUCINEA1F3R0.73
NLENORLEUCINEA,I2JXR0.73
NLENORLEUCINEC,F1A940.73
NLENORLEUCINEA,B1S4A0.73
NLENORLEUCINEA1R9V0.73
NLENORLEUCINEA,B,C,D,E,F2Z2T0.73
KAH5-AMINO-4-HYDROXYHEXANOIC ACIDA1H7P0.78
NORCYCLOHEXYL-NORSTATINEE,I1EPN0.72
NORCYCLOHEXYL-NORSTATINEP1CZI0.72
NORCYCLOHEXYL-NORSTATINEA,I1GVT0.72
NPI2-AMINOPIMELIC ACIDA2TDT0.81
NPI2-AMINOPIMELIC ACIDA1KGQ0.81
DLYD-LYSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.73
DLYD-LYSINEA1C4B0.73
DLYD-LYSINEA,B,C,D3BOG0.73
DLYD-LYSINEA1KO00.73
DLYD-LYSINEA,B,C,D3C1P0.73
DLYD-LYSINEA,B,C,H,K,L2R5D0.73
DLYD-LYSINEA,B,C,D2R3C0.73
DLYD-LYSINEA,B,C,H,K,L2R5B0.73
DLYD-LYSINEA,B2Q330.73
DLYD-LYSINEA,B2ATS0.73
DLYD-LYSINEA1RCQ0.73
DNED-NORLEUCINEA1R9V0.73
DNED-NORLEUCINEA,B1S4A0.73
DNED-NORLEUCINEA,B1S1O0.73
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RUA0.72
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RUL0.72
GHGGAMMA-HYDROXY-GLUTAMINEH,L1RU90.72
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.75
DO22-AMINO-6-OXO-HEXANOIC ACIDA,B1DJP0.73
LOV5-AMINO-4-HYDROXY-2-ISOPROPYL-7-
METHYL-OCTANOIC ACID
A,B1OEX0.72
LOV5-AMINO-4-HYDROXY-2-ISOPROPYL-7-
METHYL-OCTANOIC ACID
A,B,I8HVP0.72
LOV5-AMINO-4-HYDROXY-2-ISOPROPYL-7-
METHYL-OCTANOIC ACID
A,B1GKT0.72
LOV5-AMINO-4-HYDROXY-2-ISOPROPYL-7-
METHYL-OCTANOIC ACID
E,I2ER70.72
LDO6-HYDROXY-L-NORLEUCINEA,B,C,D1JSR0.83
6CL6-CARBOXYLYSINEU2AIZ0.8
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.85
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.8
API2,6-DIAMINOPIMELIC ACIDA2DAP0.8
API2,6-DIAMINOPIMELIC ACIDE,S148L0.8