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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02865431

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.78
DLYD-LYSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		1YWH0.83
DLYD-LYSINEA1C4B0.83
DLYD-LYSINEA,B,C,D3BOG0.83
DLYD-LYSINEA1KO00.83
DLYD-LYSINEA,B,C,D3C1P0.83
DLYD-LYSINEA,B,C,H,K,L2R5D0.83
DLYD-LYSINEA,B,C,D2R3C0.83
DLYD-LYSINEA,B,C,H,K,L2R5B0.83
DLYD-LYSINEA,B2Q330.83
DLYD-LYSINEA,B2ATS0.83
DLYD-LYSINEA1RCQ0.83
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.77
API2,6-DIAMINOPIMELIC ACIDA2DAP0.77
API2,6-DIAMINOPIMELIC ACIDE,S148L0.77
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.7
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.7
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.7
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.7
6CL6-CARBOXYLYSINEU2AIZ0.77
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D1J730.75
DAB2,4-DIAMINOBUTYRIC ACIDA1JDK0.75
DAB2,4-DIAMINOBUTYRIC ACIDA,B,C,D3D3S0.75
DAB2,4-DIAMINOBUTYRIC ACIDA,B3DS90.75
DAB2,4-DIAMINOBUTYRIC ACIDA1J9V0.75
DAB2,4-DIAMINOBUTYRIC ACIDA2PM10.75
DAB2,4-DIAMINOBUTYRIC ACIDA1JAR0.75
DAB2,4-DIAMINOBUTYRIC ACIDA,B1B4H0.75
DAVDELTA-AMINO VALERIC ACIDA1H7O0.71
DAVDELTA-AMINO VALERIC ACIDA7JDW0.71
DNED-NORLEUCINEA1R9V0.8
DNED-NORLEUCINEA,B1S4A0.8
DNED-NORLEUCINEA,B1S1O0.8
6HN6-nitro-L-norleucineA,B3F800.71
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA,B,C2OXJ0.7
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA2OXK0.7
B3L(3S)-3-amino-5-methylhexanoic acidA3C3H0.7
B3L(3S)-3-amino-5-methylhexanoic acidA3C3G0.7
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C,D3C3F0.7
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C3HEZ0.7
B3L(3S)-3-amino-5-methylhexanoic acidA,B,D,E,F3FDM0.7
DGLD-GLUTAMIC ACIDA,B2JFX0.71
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5D0.71
DGLD-GLUTAMIC ACIDA1C4B0.71
DGLD-GLUTAMIC ACIDA1CW80.71
DGLD-GLUTAMIC ACIDA,D1CZQ0.71
DGLD-GLUTAMIC ACIDA,B2JFY0.71
DGLD-GLUTAMIC ACIDI1QUR0.71
DGLD-GLUTAMIC ACIDA,D2Q3I0.71
DGLD-GLUTAMIC ACIDA1CVQ0.71
DGLD-GLUTAMIC ACIDA,B1P4N0.71
DGLD-GLUTAMIC ACIDA,B2VVT0.71
DGLD-GLUTAMIC ACIDE,S148L0.71
DGLD-GLUTAMIC ACIDA1KR60.71
DGLD-GLUTAMIC ACIDA,B,C,D2GZM0.71
DGLD-GLUTAMIC ACIDA1AY30.71
DGLD-GLUTAMIC ACIDA2J8F0.71
DGLD-GLUTAMIC ACIDU2AIZ0.71
DGLD-GLUTAMIC ACIDA,B,C2DWU0.71
DGLD-GLUTAMIC ACIDL2EAX0.71
DGLD-GLUTAMIC ACIDA,B2JFZ0.71
DGLD-GLUTAMIC ACIDH,I4THN0.71
DGLD-GLUTAMIC ACIDA1CWZ0.71
DGLD-GLUTAMIC ACIDP1MCK0.71
DGLD-GLUTAMIC ACIDA2JUE0.71
DGLD-GLUTAMIC ACIDA,B2JFO0.71
DGLD-GLUTAMIC ACIDA3H410.71
DGLD-GLUTAMIC ACIDA1D0K0.71
DGLD-GLUTAMIC ACIDL,N1WCO0.71
DGLD-GLUTAMIC ACIDA,B,C1ZUW0.71
DGLD-GLUTAMIC ACIDH,I5GDS0.71
DGLD-GLUTAMIC ACIDA,B,C,H,K,L2R5B0.71
DGLD-GLUTAMIC ACIDA,B2JFQ0.71
DGLD-GLUTAMIC ACIDA,B2Q330.71
DGLD-GLUTAMIC ACIDA,B2JFP0.71
DGLD-GLUTAMIC ACIDA,B,E,F2W4I0.71
DGLD-GLUTAMIC ACIDA2J8G0.71
DGLD-GLUTAMIC ACIDA,B,C,D2R3C0.71
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA,B,C3HEZ0.82
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA3C3G0.82
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.82
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.82
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.82
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.82
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.82
DGND-GLUTAMINEA,D2Q3I0.7
DGND-GLUTAMINEA,L1ZEA0.7
DGND-GLUTAMINEA,B2FCM0.7
DGND-GLUTAMINEA1BFW0.7
DGND-GLUTAMINEE1EPR0.7
DGND-GLUTAMINEA2JX40.7
DGND-GLUTAMINEA,B,C,D2R3C0.7
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.7
DGND-GLUTAMINEA,B2Q330.7
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.7
DGND-GLUTAMINEA,B,C1YJ10.7
DGND-GLUTAMINEA1B740.7
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.77
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.77
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.77
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.77
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.77
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.8
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.8
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.8
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.8
ACA6-AMINOHEXANOIC ACIDA,B2JT90.8
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.8
ACA6-AMINOHEXANOIC ACIDC1ILP0.8
ACA6-AMINOHEXANOIC ACIDA2PK40.8
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1M900.8
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		1VQ60.8
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.8
ACA6-AMINOHEXANOIC ACIDA1PK20.8
ACA6-AMINOHEXANOIC ACIDA2ZM70.8
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		3CMA0.8
ACA6-AMINOHEXANOIC ACIDC1ILQ0.8
ACA6-AMINOHEXANOIC ACIDA2ZM80.8
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		1VQK0.8
ACA6-AMINOHEXANOIC ACIDA2DCF0.8
ACA6-AMINOHEXANOIC ACIDA1HPK0.8
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		1VQ80.8
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		3CME0.8
ACA6-AMINOHEXANOIC ACIDA2ZM90.8
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		1VQN0.8
ACA6-AMINOHEXANOIC ACIDA2ZMA0.8
ACA6-AMINOHEXANOIC ACIDA3KIV0.8
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		1VQ90.8
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.74
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.75