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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01534885

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.72
API2,6-DIAMINOPIMELIC ACIDA2DAP0.72
API2,6-DIAMINOPIMELIC ACIDE,S148L0.72
DOA12-AMINO-DODECANOIC ACIDB1EOJ0.73
DOA12-AMINO-DODECANOIC ACIDA,D1H8T0.73
DOA12-AMINO-DODECANOIC ACIDA2DCX0.73
DOA12-AMINO-DODECANOIC ACIDB1EOL0.73
6CL6-CARBOXYLYSINEU2AIZ0.72
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.73
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.73
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.73
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.73
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.73
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.77
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.77
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.77
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.77
UN12-AMINOHEXANEDIOIC ACIDA,B,C,D1H0G0.72
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA,B,C3HEZ0.7
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA3C3G0.7
NPI2-AMINOPIMELIC ACIDA2TDT0.73
NPI2-AMINOPIMELIC ACIDA1KGQ0.73
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.76
DAVDELTA-AMINO VALERIC ACIDA1H7O0.73
DAVDELTA-AMINO VALERIC ACIDA7JDW0.73
DLYD-LYSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		1YWH0.74
DLYD-LYSINEA1C4B0.74
DLYD-LYSINEA,B,C,D3BOG0.74
DLYD-LYSINEA1KO00.74
DLYD-LYSINEA,B,C,D3C1P0.74
DLYD-LYSINEA,B,C,H,K,L2R5D0.74
DLYD-LYSINEA,B,C,D2R3C0.74
DLYD-LYSINEA,B,C,H,K,L2R5B0.74
DLYD-LYSINEA,B2Q330.74
DLYD-LYSINEA,B2ATS0.74
DLYD-LYSINEA1RCQ0.74
DNED-NORLEUCINEA1R9V0.77
DNED-NORLEUCINEA,B1S4A0.77
DNED-NORLEUCINEA,B1S1O0.77
VIG4-AMINO HEXANOIC ACIDA,B,C,D1OHW0.75
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.73
NLENORLEUCINEA1MMT0.77
NLENORLEUCINEA,B1JB60.77
NLENORLEUCINEC1K2B0.77
NLENORLEUCINEA,B,C2AVQ0.77
NLENORLEUCINEC,D,I,L1R1L0.77
NLENORLEUCINEE,S2RLN0.77
NLENORLEUCINEE,S1Z3L0.77
NLENORLEUCINEA,B,C2AOD0.77
NLENORLEUCINEA,B,C2J9J0.77
NLENORLEUCINEA,B,I4HVP0.77
NLENORLEUCINEA,B,C2AVM0.77
NLENORLEUCINEB,C1K1T0.77
NLENORLEUCINEA,B,C2AOC0.77
NLENORLEUCINEA,B,C2JE40.77
NLENORLEUCINEA,B,I3DCK0.77
NLENORLEUCINEB1EOL0.77
NLENORLEUCINEA1FF00.77
NLENORLEUCINEA1FG60.77
NLENORLEUCINEA1FGC0.77
NLENORLEUCINEE,S1Z3M0.77
NLENORLEUCINEA2RME0.77
NLENORLEUCINEB1FGL0.77
NLENORLEUCINEC1K1U0.77
NLENORLEUCINEA,B1B7H0.77
NLENORLEUCINEA1HTH0.77
NLENORLEUCINEA,B,D2J9K0.77
NLENORLEUCINEA2RMD0.77
NLENORLEUCINEA,B,C2AOG0.77
NLENORLEUCINEA2RMI0.77
NLENORLEUCINEI1EPO0.77
NLENORLEUCINEA1FFI0.77
NLENORLEUCINEA1HD90.77
NLENORLEUCINEA1FFF0.77
NLENORLEUCINEB2JND0.77
NLENORLEUCINEA1FEJ0.77
NLENORLEUCINEA2K9E0.77
NLENORLEUCINEC1CFN0.77
NLENORLEUCINEC1K2C0.77
NLENORLEUCINEA1WY40.77
NLENORLEUCINEA1FQ80.77
NLENORLEUCINEA,B1S1O0.77
NLENORLEUCINEA2F4K0.77
NLENORLEUCINEA,B1D5E0.77
NLENORLEUCINEA2JX40.77
NLENORLEUCINEA1FG80.77
NLENORLEUCINEA1WY30.77
NLENORLEUCINEI1YTJ0.77
NLENORLEUCINEA,B,I3DCR0.77
NLENORLEUCINEA,I2O400.77
NLENORLEUCINEA,B2GYP0.77
NLENORLEUCINEC,F1A8K0.77
NLENORLEUCINEC1BAI0.77
NLENORLEUCINEA,B2JT90.77
NLENORLEUCINEA2RM90.77
NLENORLEUCINEA,B1DAZ0.77
NLENORLEUCINEA1F3R0.77
NLENORLEUCINEA,I2JXR0.77
NLENORLEUCINEC,F1A940.77
NLENORLEUCINEA,B1S4A0.77
NLENORLEUCINEA1R9V0.77
NLENORLEUCINEA,B,C,D,E,F2Z2T0.77
ACA6-AMINOHEXANOIC ACIDA,B2JT90.82
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.82
ACA6-AMINOHEXANOIC ACIDC1ILP0.82
ACA6-AMINOHEXANOIC ACIDA2PK40.82
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1M900.82
ACA6-AMINOHEXANOIC ACID0,1,3,4,5,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		1VQ60.82
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.82
ACA6-AMINOHEXANOIC ACIDA1PK20.82
ACA6-AMINOHEXANOIC ACIDA2ZM70.82
ACA6-AMINOHEXANOIC ACID0,1,2,3,6,9,
A,B,C,D,F,H,
J,K,L,M,N,O,
Q,R,S,T,U,Y,Z		3CMA0.82
ACA6-AMINOHEXANOIC ACIDC1ILQ0.82
ACA6-AMINOHEXANOIC ACIDA2ZM80.82
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQK0.82
ACA6-AMINOHEXANOIC ACIDA2DCF0.82
ACA6-AMINOHEXANOIC ACIDA1HPK0.82
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQ80.82
ACA6-AMINOHEXANOIC ACID0,1,2,3,6,9,
A,B,C,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		3CME0.82
ACA6-AMINOHEXANOIC ACIDA2ZM90.82
ACA6-AMINOHEXANOIC ACID0,1,2,3,4,5,
9,A,B,C,D,F,
H,J,K,L,M,N,
O,Q,R,S,T,U,
Y,Z		1VQN0.82
ACA6-AMINOHEXANOIC ACIDA2ZMA0.82
ACA6-AMINOHEXANOIC ACIDA3KIV0.82
ACA6-AMINOHEXANOIC ACID0,1,3,4,9,A,
B,C,D,F,H,J,
K,L,M,N,O,Q,
R,S,T,U,Y,Z		1VQ90.82