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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00482120

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DSEN-METHYL-D-SERINEC1CWH0.72
NXAN-CARBOXYALANINEA2IUX0.78
NXAN-CARBOXYALANINEA1O8A0.78
IPGN-ISOPROPYL GLYCINEC,D2SEM0.79
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.78
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.78
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.78
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.71
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.77
MAAN-METHYLALANINEA,B1A7Z0.77
MAAN-METHYLALANINEA,B2VSL0.77
MAAN-METHYLALANINEC1CWI0.77
MAAN-METHYLALANINEC,F,G,H3DW80.77
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYL0.77
MAAN-METHYLALANINED1D5X0.77
MAAN-METHYLALANINEC1PYW0.77
MAAN-METHYLALANINEA,B,C,D,E,F,
G,H
2NYM0.77
MAAN-METHYLALANINEC,I2IE30.77
MAAN-METHYLALANINEC,F,X,Y2NPP0.77
AACACETYLAMINO-ACETIC ACIDA,B1NG30.79
AACACETYLAMINO-ACETIC ACIDA1QD80.79
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.76
AN0N-ACETYL-L-NORVALINEA1ZQ80.76
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.73
THCN-METHYLCARBONYLTHREONINEB2HR00.73
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.73
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.73
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2EIL0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,Z
2DYR0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2EIM0.8
SACN-ACETYL-SERINEA1R4U0.8
SACN-ACETYL-SERINEA,B,C,D1WS30.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1XY30.8
SACN-ACETYL-SERINEA,B1EVU0.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,H
1R560.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Z
2DYS0.8
SACN-ACETYL-SERINEA1WRR0.8
SACN-ACETYL-SERINEA,B,C,D,E,F,
G,I,J,L,M,N,
O,P,Q,S,T,V,
W,Z
1V540.8
SACN-ACETYL-SERINEA,B3CVQ0.8
SACN-ACETYL-SERINEA1B0B0.8
SACN-ACETYL-SERINEA1XT40.8
SACN-ACETYL-SERINEA,B,C,F,G,I,
J,L,M,N,O,P,
S,T,V,W,Z
2EIJ0.8
SACN-ACETYL-SERINEA2FXL0.8
SACN-ACETYL-SERINEA1R4S0.8
SACN-ACETYL-SERINEA,B,C,D1WS20.8
SACN-ACETYL-SERINEA,B,C,D2AUC0.8
SACN-ACETYL-SERINEA,B,C,D,F,G,
I,J,L,M,N,O,
P,S,T,V,W,Y,Z
2EIN0.8
SACN-ACETYL-SERINEA1R510.8
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,M,N,O,P,
Q,S,T,V,W,Z
1V550.8
SACN-ACETYL-SERINEA,B,C,D1XXJ0.8
SACN-ACETYL-SERINET2QAC0.8
SACN-ACETYL-SERINEA,B,C,E,F,G,
I,J,L,M,N,O,
P,Q,S,T,V,W,
Y,Z
2EIK0.8
AMEN-ACETYLMETHIONINEA,B,C,D1SJA0.71
AMEN-ACETYLMETHIONINEA,B2J4Y0.71
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.76
0AAmethyl L-valinateI1HEF0.7
BAA(TERT-BUTYLOXYCARBONYL)-ALANYL-
ALANYL-AMINE
A1ELG0.7
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.7
OGAN-OXALYOLGLYCINEA2RDS0.7
OGAN-OXALYOLGLYCINEA1H2M0.7
OGAN-OXALYOLGLYCINEA2QRL0.7
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.7
OGAN-OXALYOLGLYCINEA2RDR0.7
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.7
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.7
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.7
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.7
OGAN-OXALYOLGLYCINEA1H2K0.7
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.7
OGAN-OXALYOLGLYCINEA,B2OQ70.7
AYAN-ACETYLALANINEA1D0W0.88
AYAN-ACETYLALANINEA1AH40.88
AYAN-ACETYLALANINEA,B1VBP0.88
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1J4T0.88
AYAN-ACETYLALANINEA,B,C,D1OUW0.88
AYAN-ACETYLALANINEA1AH30.88
AYAN-ACETYLALANINEA1EKO0.88
AYAN-ACETYLALANINEB,D,F,H2V4I0.88
AYAN-ACETYLALANINEA,B,C,D,E,F,
G,H
1VBO0.88
AYAN-ACETYLALANINEA,B,C,D1J4U0.88
VMEMETHYL L-VALINATEA,B,C2JE40.7
VMEMETHYL L-VALINATEA,B,C2J9J0.7
VMEMETHYL L-VALINATEA,B,C7HVP0.7