MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02346611

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

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2OUA	0.71
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B,C,D	2AJC	0.71
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	3PRO	0.71
2AB	4-(2-AMINOETHYL)BENZENESULFONIC ACID	A,B	2PFE	0.71
TSU	PARA-TOLUENE SULFONATE	A,B	1WUW	0.71
TSU	PARA-TOLUENE SULFONATE	A	1B0D	0.71
ZYX	4-(2-AMINOETHYL)BENZENESULFONAMIDE	A	2NNG	0.73
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOJ	0.7
BBS	4-TERT-BUTYLBENZENESULFONIC ACID	B	1EOL	0.7
PVS	(ethenylsulfonyl)benzene	A	3BLU	0.72
PTF	[(METHYLSULFANYL)METHYL]BENZENE	C,F	1RHQ	0.78
DPK	DEPRENYL	A,B	2BYB	0.73
3BT	2-{2-[3-(2-CARBAMIMIDOYLSULFANYL- ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA	A,B	1D1Y	0.7
SML	PHENYL METHYL SULFONE	A,I	1D6W	0.71
SML	PHENYL METHYL SULFONE	A,I	1D9I	0.71
4BT	2-{2-[4-(2-CARBAMIMIDOYLSULFANYL- ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA	A,B	1D1X	0.7
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.71
HZH	1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan- 2-one	A,B	3DEA	0.72
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3B2Q	0.74
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4T	0.74
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	O,P,Q,R	2B4R	0.74
AES	4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE	A,B	3EIU	0.74
B69		A	2ZCR	0.7
BCS	BENZYLCYSTEINE	A,B,G,H	10GS	0.7
BCS	BENZYLCYSTEINE	A	1EH8	0.7
BHY	N,N'-[biphenyl-4,4'-diyldi(2R)propane- 2,1-diyl]dimethanesulfonamide	A,B	3BBR	0.7
SEH	S-BENZYL PHENYLACETOTHIOHYDROXIMATE- O-SULFATE	M	1W9D	0.76
PMS	BENZYLSULFINIC ACID	B	1PNM	0.75
PMS	BENZYLSULFINIC ACID	A,B	1SH7	0.75
PMS	BENZYLSULFINIC ACID	B,C	1BB0	0.75
PMS	BENZYLSULFINIC ACID	A,B	1S2N	0.75
PMS	BENZYLSULFINIC ACID	A,B	1WB8	0.75
PMS	BENZYLSULFINIC ACID	A,B,C	3CE4	0.75
PMS	BENZYLSULFINIC ACID	A,B	1Y9Z	0.75
PMS	BENZYLSULFINIC ACID	A	3H18	0.75
PMS	BENZYLSULFINIC ACID	A	3H17	0.75
PMS	BENZYLSULFINIC ACID	A	2CBG	0.75
PMS	BENZYLSULFINIC ACID	A	1SUP	0.75
PMS	BENZYLSULFINIC ACID	A,B	1V6C	0.75
PMS	BENZYLSULFINIC ACID	A,B	1WPR	0.75
PMS	BENZYLSULFINIC ACID	A,B	1EQ9	0.75
PMS	BENZYLSULFINIC ACID	A,B	1AUR	0.75
PMS	BENZYLSULFINIC ACID	A	1KLT	0.75
PMS	BENZYLSULFINIC ACID	B,C	1CA8	0.75
PMS	BENZYLSULFINIC ACID	A	2GKO	0.75
PMS	BENZYLSULFINIC ACID	B,C,D	1BA8	0.75
DMX	3-[BENZYL(DIMETHYL)AMMONIO]PROPANE- 1-SULFONATE	A,B,C,D	1TP7	0.83