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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03201555

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B1UR90.78
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B,C,D,E,F1O7A0.78
GDL2-ACETAMIDO-2-DEOXY-D-GLUCONO-1,5-
LACTONE
A,B1UR80.78
C6LN-hexanoyl-L-homoserineA3DHA0.71
C6LN-hexanoyl-L-homoserineA3DHB0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B1O5K0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B3CPR0.71
MCLNZ-(1-CARBOXYETHYL)-LYSINEA,B2VC60.71
W726-DEOXY-6-[(2R,3R,4R)-3,4-DIHYDROXY-
2-(HYDROXYMETHYL)PYRROLIDIN-1-YL]-
L-GULONIC ACID
A2FYV0.78
HYP4-HYDROXYPROLINEA1OB40.71
HYP4-HYDROXYPROLINEA,B,C1QSU0.71
HYP4-HYDROXYPROLINEA,C,E,G,I,K,
M,O
1GK80.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.71
HYP4-HYDROXYPROLINEE,F,G,H,I,J2F6A0.71
HYP4-HYDROXYPROLINEA1TCH0.71
HYP4-HYDROXYPROLINEA1KCP0.71
HYP4-HYDROXYPROLINEA2JTU0.71
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M1K830.71
HYP4-HYDROXYPROLINEA3E2Q0.71
HYP4-HYDROXYPROLINEA1TR60.71
HYP4-HYDROXYPROLINEA1P1P0.71
HYP4-HYDROXYPROLINEB,C,E,F,H,I,
K,L,M,N,O,P,
Q,R,S,T
2HOD0.71
HYP4-HYDROXYPROLINEA,B,C,D2V530.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.71
HYP4-HYDROXYPROLINEA2VUV0.71
HYP4-HYDROXYPROLINEA1EYO0.71
HYP4-HYDROXYPROLINED,H2FES0.71
HYP4-HYDROXYPROLINEA,B,E,F3EJH0.71
HYP4-HYDROXYPROLINEA2JQB0.71
HYP4-HYDROXYPROLINEA2P4L0.71
HYP4-HYDROXYPROLINEA2H9X0.71
HYP4-HYDROXYPROLINEA1AV30.71
HYP4-HYDROXYPROLINEA1TCJ0.71
HYP4-HYDROXYPROLINEA2IHA0.71
HYP4-HYDROXYPROLINEA,B,C1BKV0.71
HYP4-HYDROXYPROLINEA1R9U0.71
HYP4-HYDROXYPROLINEA1AG70.71
HYP4-HYDROXYPROLINEA1GQ00.71
HYP4-HYDROXYPROLINEA1R9I0.71
HYP4-HYDROXYPROLINEH1LM80.71
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F1EI80.71
HYP4-HYDROXYPROLINEA,B,C1Q7D0.71
HYP4-HYDROXYPROLINEA1VIB0.71
HYP4-HYDROXYPROLINED,H2FEQ0.71
HYP4-HYDROXYPROLINEA1DG00.71
HYP4-HYDROXYPROLINEB,C,D,F1DZI0.71
HYP4-HYDROXYPROLINEA1GIB0.71
HYP4-HYDROXYPROLINEA,D1LQB0.71
HYP4-HYDROXYPROLINEA,B,C3DMW0.71
HYP4-HYDROXYPROLINEA2JQC0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F1X1K0.71
HYP4-HYDROXYPROLINEA1IEO0.71
HYP4-HYDROXYPROLINED,H1NZQ0.71
HYP4-HYDROXYPROLINEA2JRY0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.71
HYP4-HYDROXYPROLINEA,B1JOH0.71
HYP4-HYDROXYPROLINEA1PQR0.71
HYP4-HYDROXYPROLINEA1TTL0.71
HYP4-HYDROXYPROLINEA2B5Q0.71
HYP4-HYDROXYPROLINEA,B,C1CAG0.71
HYP4-HYDROXYPROLINEA2EW40.71
HYP4-HYDROXYPROLINEB,C,E,F,G,H2HLO0.71
HYP4-HYDROXYPROLINEA2YYF0.71
HYP4-HYDROXYPROLINEA1G1P0.71
HYP4-HYDROXYPROLINEA,B,D,E,H,K,
O,R,V
1UWA0.71
HYP4-HYDROXYPROLINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.71
HYP4-HYDROXYPROLINEA2VUZ0.71
HYP4-HYDROXYPROLINEA1QFB0.71
HYP4-HYDROXYPROLINED,H1O0D0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3F0.71
HYP4-HYDROXYPROLINEA2J150.71
HYP4-HYDROXYPROLINEA1DFZ0.71
HYP4-HYDROXYPROLINEA,B1OB60.71
HYP4-HYDROXYPROLINEA,B,C,I,J,L,M3CQZ0.71
HYP4-HYDROXYPROLINE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z
1IR20.71
HYP4-HYDROXYPROLINEA1TCK0.71
HYP4-HYDROXYPROLINEA1G1Z0.71
HYP4-HYDROXYPROLINEA,B,D,E,F,G1YM80.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.71
HYP4-HYDROXYPROLINEA1MTQ0.71
HYP4-HYDROXYPROLINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.71
HYP4-HYDROXYPROLINEA,B,C1V7H0.71
HYP4-HYDROXYPROLINEA,B,G2G660.71
HYP4-HYDROXYPROLINEA1OB70.71
HYP4-HYDROXYPROLINEA1OMC0.71
HYP4-HYDROXYPROLINEX2HCZ0.71
HYP4-HYDROXYPROLINEA1DFY0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F2D3H0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.71
HYP4-HYDROXYPROLINEA1IH90.71
HYP4-HYDROXYPROLINEA2IH60.71
HYP4-HYDROXYPROLINEA2IH70.71
HYP4-HYDROXYPROLINEA1JLP0.71
HYP4-HYDROXYPROLINEA,C,E,F2W650.71
HYP4-HYDROXYPROLINEA1AS50.71
HYP4-HYDROXYPROLINEA,B,C1V6Q0.71
HYP4-HYDROXYPROLINEA,B,C1V4F0.71
HYP4-HYDROXYPROLINEA,B,C1Y0F0.71
HYP4-HYDROXYPROLINEA,B,C2DRX0.71
HYP4-HYDROXYPROLINEA1K640.71
HYP4-HYDROXYPROLINEA,B,C1YGV0.71
HYP4-HYDROXYPROLINEA2B5P0.71
HYP4-HYDROXYPROLINEA,B,C2DRT0.71
HYP4-HYDROXYPROLINEA2CCO0.71
HYP4-HYDROXYPROLINEA1WCT0.71
HYP4-HYDROXYPROLINEA1D7T0.71
HYP4-HYDROXYPROLINEA1JLO0.71
HYP4-HYDROXYPROLINEA,B,C1CGD0.71
HYP4-HYDROXYPROLINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.71
HYP4-HYDROXYPROLINEH,P2A2X0.71
HYP4-HYDROXYPROLINEA1DLZ0.71
HYP4-HYDROXYPROLINEA,B,C,I,J,L,
M,T
2VUM0.71
HYP4-HYDROXYPROLINEA1TCG0.71
HYP4-HYDROXYPROLINEH,P2ANK0.71
HYP4-HYDROXYPROLINEA,B,C1WZB0.71
HYP4-HYDROXYPROLINEA1BDK0.71
SUJ(2R,3R)-2-[(3S,6R)-3-AMINO-6-HYDROXY-
2-OXOPIPERIDINYL]-3-HYDROXYBUTANOIC ACID
C,D1OKX0.71
NAU4,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDONONANOIC ACIDA,C1F7B0.72
KGCN~6~-[(2R)-2-CARBOXY-5-OXOTETRAHYDROFURAN-
2-YL]-L-LYSINE
A,B2OJP0.72
KGCN~6~-[(2R)-2-CARBOXY-5-OXOTETRAHYDROFURAN-
2-YL]-L-LYSINE
A,B3DEN0.72
KGCN~6~-[(2R)-2-CARBOXY-5-OXOTETRAHYDROFURAN-
2-YL]-L-LYSINE
A,B2PUR0.72
NAY6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO-
2-OXONONANOIC ACID
A,C1F740.76
SHRN-(5-AMINO-5-CARBOXYPENTYL)GLUTAMIC ACIDA,B,C,D,E,F,
G,H
1E5Q0.72
NAV6,7,8,9-TETRAHYDROXY-5-METHYLCARBOXAMIDO-
4-OXONONANOIC ACID
A,C1F7B0.79
LLYNZ-(DICARBOXYMETHYL)LYSINEA,B1UCW0.75
HY33-HYDROXYPROLINEA,B,G2G660.72
0AZ(4R)-4-hydroxy-L-prolineA1GQ00.71
UDC(2S,3S)-2-((2S,3R,4S,5R)-5-ETHANAMIDO-
3-HYDROXY-2-(HYDROXYMETHYL)TETRAHYDRO-
2H-PYRAN-4-YLOXY)-3,4-DIHYDROXY-
2-METHYLBUTANOIC ACID
A,B,C,D2Z2C0.73
H5MTRANS-3-HYDROXY-5-METHYLPROLINEA,B1A7Z0.73
HMN2,4,6,7,8,9-HEXAHYDROXY-5-METHYLCARBOXAMIDO NONANOIC ACIDA,B,C,D1F730.74
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PPP0.7
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1PE60.7
E6CN-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
2-METHYL-BUTANE
A1ITO0.7