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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03201726

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
0AZ(4R)-4-hydroxy-L-prolineA1GQ00.75
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J320.72
ASKDEHYDROXYMETHYLASPARTIC ACIDE,F1JXQ0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I2F4O0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I1X3Z0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJX0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J330.72
ASKDEHYDROXYMETHYLASPARTIC ACIDT,U,V,W,X,Y1QDU0.72
ASKDEHYDROXYMETHYLASPARTIC ACIDC,D1CP30.72
ASKDEHYDROXYMETHYLASPARTIC ACIDA,B,C,D,E,F1M720.72
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J300.72
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J310.72
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJY0.72
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.73
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA3C3G0.74
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA2OXK0.74
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C,D3C3F0.74
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C3HEZ0.74
B3E(3S)-3-AMINOHEXANEDIOIC ACIDA,B,C2OXJ0.74
ALOALLO-THREONINEI,P1HDT0.72
ALOALLO-THREONINEA2JUU0.72
ALOALLO-THREONINEA2VMX0.72
ACA6-AMINOHEXANOIC ACIDA,B2JT90.75
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.75
ACA6-AMINOHEXANOIC ACIDC1ILP0.75
ACA6-AMINOHEXANOIC ACIDA2PK40.75
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1M900.75
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		1VQ60.75
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.75
ACA6-AMINOHEXANOIC ACIDA1PK20.75
ACA6-AMINOHEXANOIC ACIDA2ZM70.75
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		3CMA0.75
ACA6-AMINOHEXANOIC ACIDC1ILQ0.75
ACA6-AMINOHEXANOIC ACIDA2ZM80.75
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		1VQK0.75
ACA6-AMINOHEXANOIC ACIDA2DCF0.75
ACA6-AMINOHEXANOIC ACIDA1HPK0.75
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		1VQ80.75
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		3CME0.75
ACA6-AMINOHEXANOIC ACIDA2ZM90.75
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		1VQN0.75
ACA6-AMINOHEXANOIC ACIDA2ZMA0.75
ACA6-AMINOHEXANOIC ACIDA3KIV0.75
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		1VQ90.75
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA,B,C3HEZ0.77
B3Q(3S)-3,6-diamino-6-oxohexanoic acidA3C3G0.77
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA3C3G0.76
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C2OXJ0.76
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C,D3C3F0.76
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA,B,C3HEZ0.76
B3K(3S)-3,7-DIAMINOHEPTANOIC ACIDA2OXK0.76
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.81
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.81
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.81
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.81
6CL6-CARBOXYLYSINEU2AIZ0.79
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
API2,6-DIAMINOPIMELIC ACIDA,B1E8C0.79
API2,6-DIAMINOPIMELIC ACIDA2DAP0.79
API2,6-DIAMINOPIMELIC ACIDE,S148L0.79
AA42-AMINO-5-HYDROXYPENTANOIC ACIDB1MIK0.77
AA42-AMINO-5-HYDROXYPENTANOIC ACIDE,I1QR30.77
AHP2-AMINO-HEPTANOIC ACIDD1J4X0.77
6HN6-nitro-L-norleucineA,B3F800.74
AHHAMINO-HYDROXYHEPTANOIC ACIDA,I3MAT0.79
AVG2-AMINO-4-(2-AMINO-ETHOXY)-BUTYRIC ACIDA1IAY0.75
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.8
AHY(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACIDA,D2J9A0.75
AROC-GAMMA-HYDROXY ARGININEA,B,C,D,E,F1FFV0.71
AROC-GAMMA-HYDROXY ARGININEA,B,C,D,E,F1FFU0.71