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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00015074

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LDO6-HYDROXY-L-NORLEUCINEA,B,C,D1JSR0.7
UN12-AMINOHEXANEDIOIC ACIDA,B,C,D1H0G0.74
ORNORNITHINEE1LAH0.81
ORNORNITHINEB,C,E,F,H,I,
K,L		1JDB0.81
ORNORNITHINEA,Y1TK20.81
ORNORNITHINEA,B,C2W6U0.81
ORNORNITHINEA1T5M0.81
ORNORNITHINEA,B,C,D,E,G,H1BXR0.81
ORNORNITHINEA,B,C,D,E,F,
G,H		1KEE0.81
ORNORNITHINEA,B,C1HQG0.81
ORNORNITHINEA,B,C2W6T0.81
ORNORNITHINEA,B1X7D0.81
ORNORNITHINEA1T5N0.81
ORNORNITHINEA,B,C,D,E,F,
G,H		1CE80.81
ORNORNITHINEA1DSR0.81
ORNORNITHINEA,B,C,D,E,F,
G,H		1A9X0.81
ORNORNITHINEH,K,L,M,P,R1N0X0.81
ORNORNITHINEA,B2PM50.81
ORNORNITHINEA,B,C,D,E,F,
G,H		1CS00.81
ORNORNITHINEE,I1QR30.81
ORNORNITHINEA1HTH0.81
ORNORNITHINEA,B,C,D,E,F,
G,H		1M6V0.81
ORNORNITHINEA,B,C,D,E,F,
G,H		1C3O0.81
ORNORNITHINEA,B,C,D,E,F,
G,H		1C300.81
ORNORNITHINEA1XT70.81
ORNORNITHINEA3JDW0.81
ORNORNITHINEA,B,C,D,E,F,
G,H		1T360.81
ORNORNITHINEA,B1B2H0.81
ORNORNITHINEA,B,C,D,E,F4CEV0.81
ONL5-OXO-L-NORLEUCINEA,B1ECG0.71
ONL5-OXO-L-NORLEUCINEA,B,C,D3DLA0.71
ONL5-OXO-L-NORLEUCINEA,X2Q3Z0.71
ONL5-OXO-L-NORLEUCINEA,B1ECC0.71
ONL5-OXO-L-NORLEUCINEA,B3BRM0.71
ONL5-OXO-L-NORLEUCINEA,B1OFE0.71
ONL5-OXO-L-NORLEUCINEA,B2J6H0.71
ACA6-AMINOHEXANOIC ACIDA,B2JT90.77
ACA6-AMINOHEXANOIC ACIDA,B1CEA0.77
ACA6-AMINOHEXANOIC ACIDC1ILP0.77
ACA6-AMINOHEXANOIC ACIDA2PK40.77
ACA6-AMINOHEXANOIC ACID1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z		1M900.77
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		1VQ60.77
ACA6-AMINOHEXANOIC ACID0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z		1KQS0.77
ACA6-AMINOHEXANOIC ACIDA1PK20.77
ACA6-AMINOHEXANOIC ACIDA2ZM70.77
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		3CMA0.77
ACA6-AMINOHEXANOIC ACIDC1ILQ0.77
ACA6-AMINOHEXANOIC ACIDA2ZM80.77
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		1VQK0.77
ACA6-AMINOHEXANOIC ACIDA2DCF0.77
ACA6-AMINOHEXANOIC ACIDA1HPK0.77
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		1VQ80.77
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		3CME0.77
ACA6-AMINOHEXANOIC ACIDA2ZM90.77
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		1VQN0.77
ACA6-AMINOHEXANOIC ACIDA2ZMA0.77
ACA6-AMINOHEXANOIC ACIDA3KIV0.77
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		1VQ90.77
DPL4-OXOPROLINEA,B,C1QFI0.72
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA,B,C,D2APH0.72
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDB2FCI0.72
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA1B9U0.72
GMA4-AMIDO-4-CARBAMOYL-BUTYRIC ACIDA,P1TWQ0.72
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B1D3V0.73
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2PLL0.73
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6K0.73
ABH2(S)-AMINO-6-BORONOHEXANOIC ACIDA,B3E6V0.73
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA,B,C2OXJ0.7
B3X(3S)-3,5-DIAMINO-5-OXOPENTANOIC ACIDA2OXK0.7
26P2-AMINO-6-OXOPIMELIC ACIDA3TDT0.7
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.71
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HOZ0.76
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP20.76
HOZ(4S)-4,5-DIAMINOPENTANOIC ACIDA,B2HP10.76
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
DDO6-HYDROXY-D-NORLEUCINEA,B,C,D1JSL0.7
NVANORVALINEB,C1CA80.75
NVANORVALINEB,C,D1BA80.75
NVANORVALINEA1C9Y0.75
NVANORVALINEA,D2BTE0.75
NVANORVALINEA1OBH0.75
NVANORVALINEE,S1Z3P0.75
NVANORVALINEA1ZNM0.75
NVANORVALINEA1JDX0.75
NVANORVALINEA1FB50.75
NVANORVALINEA1OBC0.75
NVANORVALINE11YYY0.75
NVANORVALINEA,B1B6H0.75
NVANORVALINEA,B1ZZZ0.75
NVANORVALINEA,B,C2I6U0.75
NVANORVALINEB,C1BB00.75
NVANORVALINEE,S1Z3M0.75
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
DGND-GLUTAMINEA,D2Q3I0.74
DGND-GLUTAMINEA,L1ZEA0.74
DGND-GLUTAMINEA,B2FCM0.74
DGND-GLUTAMINEA1BFW0.74
DGND-GLUTAMINEE1EPR0.74
DGND-GLUTAMINEA2JX40.74
DGND-GLUTAMINEA,B,C,D2R3C0.74
DGND-GLUTAMINEA,B,C,H,K,L2R5D0.74
DGND-GLUTAMINEA,B2Q330.74
DGND-GLUTAMINEA,B,C,H,K,L2R5B0.74
DGND-GLUTAMINEA,B,C1YJ10.74
DGND-GLUTAMINEA1B740.74
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J320.8
ASKDEHYDROXYMETHYLASPARTIC ACIDE,F1JXQ0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I2F4O0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDA,I1X3Z0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJX0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J330.8
ASKDEHYDROXYMETHYLASPARTIC ACIDT,U,V,W,X,Y1QDU0.8
ASKDEHYDROXYMETHYLASPARTIC ACIDC,D1CP30.8
ASKDEHYDROXYMETHYLASPARTIC ACIDA,B,C,D,E,F1M720.8
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J300.8
ASKDEHYDROXYMETHYLASPARTIC ACIDB2J310.8
ASKDEHYDROXYMETHYLASPARTIC ACIDI2CJY0.8
DNED-NORLEUCINEA1R9V0.73
DNED-NORLEUCINEA,B1S4A0.73
DNED-NORLEUCINEA,B1S1O0.73
DAVDELTA-AMINO VALERIC ACIDA1H7O0.86
DAVDELTA-AMINO VALERIC ACIDA7JDW0.86
DMOALPHA-DIFLUOROMETHYLORNITHINEA,B,C,D2TOD0.71