MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00045159

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
2S3	(2S)-2-(1H-indol-3-yl)pentanoic acid	B	3C6P	0.7
CBB	1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE- 2-CARBOXYLIC ACID 3-CARBAMIMIDOYL- BENZYLESTER	B	1LPK	0.71
OAI	6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACID	A	1C83	0.7
PMC	3-(PHOSPHONOMETHYL)PYRIDINE-2-CARBOXYLIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1I43	0.73
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	1GH0	0.71
CYC	PHYCOCYANOBILIN	A,B	2VJR	0.71
CYC	PHYCOCYANOBILIN	A,B,K,L,M,N	1F99	0.71
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, H,I,J,K,L,M	1B33	0.71
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUM	0.71
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUN	0.71
CYC	PHYCOCYANOBILIN	A,B	2C7L	0.71
CYC	PHYCOCYANOBILIN	A,B,K,L	1CPC	0.71
CYC	PHYCOCYANOBILIN	A,B	1JBO	0.71
CYC	PHYCOCYANOBILIN	A,B	1I7Y	0.71
CYC	PHYCOCYANOBILIN	A,B	1ON7	0.71
CYC	PHYCOCYANOBILIN	A,B,K,L	1EYX	0.71
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	1HA7	0.71
CYC	PHYCOCYANOBILIN	A,B	1ALL	0.71
CYC	PHYCOCYANOBILIN	A,B	1KTP	0.71
CYC	PHYCOCYANOBILIN	A,B	2C7K	0.71
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUL	0.71
CYC	PHYCOCYANOBILIN	A	2VEA	0.71
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, G,H,I,J,K,L	2VML	0.71
CYC	PHYCOCYANOBILIN	A	2K2N	0.71
CYC	PHYCOCYANOBILIN	A,B	2VJT	0.71
CYC	PHYCOCYANOBILIN	A,B	1PHN	0.71
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, G,H	3DBJ	0.71
CYC	PHYCOCYANOBILIN	A,B	2G9M	0.71
CYC	PHYCOCYANOBILIN	A,B	1KN1	0.71
CYC	PHYCOCYANOBILIN	A,B,K,L	1LIA	0.71
CYC	PHYCOCYANOBILIN	A,B,C,D,E,F, K,L,M,N,O,P	2BV8	0.71
CYC	PHYCOCYANOBILIN	A,B	2C7J	0.71
CYC	PHYCOCYANOBILIN	A,B	2V8A	0.71
MBV	MESOBILIVERDIN IV ALPHA	A	1HE3	0.71
BLA	BILIVERDINE IX ALPHA	A	1HE2	0.7
BLA	BILIVERDINE IX ALPHA	A	1ZTU	0.7
BLA	BILIVERDINE IX ALPHA	A	2D1E	0.7
BLA	BILIVERDINE IX ALPHA	A,B	2C7J	0.7
BLA	BILIVERDINE IX ALPHA	A,B,K,L	1EYX	0.7
BLA	BILIVERDINE IX ALPHA	A	1BVC	0.7
BLA	BILIVERDINE IX ALPHA	A,B	1KTP	0.7
BLA	BILIVERDINE IX ALPHA	A,B	2C7K	0.7
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUL	0.7
BLA	BILIVERDINE IX ALPHA	A	1S8C	0.7
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, G,H	3C2W	0.7
BLA	BILIVERDINE IX ALPHA	A,B	2C7L	0.7
BLA	BILIVERDINE IX ALPHA	A,B,C,D	2VGR	0.7
BLA	BILIVERDINE IX ALPHA	A	1J2C	0.7
BLA	BILIVERDINE IX ALPHA	A,B	3BRP	0.7
BLA	BILIVERDINE IX ALPHA	A	1BVD	0.7
BLA	BILIVERDINE IX ALPHA	A,B,K,L,M,N	1F99	0.7
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUM	0.7
BLA	BILIVERDINE IX ALPHA	A,B	2VUE	0.7
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, H,I,J,K,L,M	1B33	0.7
BLA	BILIVERDINE IX ALPHA	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	2UUN	0.7
BLA	BILIVERDINE IX ALPHA	A,B,C,D	2VCK	0.7
IAC	1H-INDOL-3-YLACETIC ACID	B	2P1Q	0.7
IAC	1H-INDOL-3-YLACETIC ACID	A	2OYF	0.7
IAC	1H-INDOL-3-YLACETIC ACID	A,B	3FVU	0.7
IAC	1H-INDOL-3-YLACETIC ACID	B	2P1P	0.7
6PC	PYRIDINE-2-CARBOXYLIC ACID	A	2OLN	0.72
6PC	PYRIDINE-2-CARBOXYLIC ACID	A	2OLO	0.72
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B,C	2W2I	0.73
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A	2GKL	0.73
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B	2VD7	0.73
PD2	PYRIDINE-2,4-DICARBOXYLIC ACID	A,B	2JIG	0.73
NTM	QUINOLINIC ACID	A	3C2O	0.73
NTM	QUINOLINIC ACID	A,B	1QAP	0.73
NTM	QUINOLINIC ACID	A,B,C,D,E,F	1QPQ	0.73
NTM	QUINOLINIC ACID	A,B,C	2B7N	0.73
CLI	3-(2-CARBOXY-ETHYL)-4,6-DICHLORO- 1H-INDOLE-2-CARBOXYLIC ACID	A,F	1LEV	0.76
CRR	3,4-DI-1H-INDOL-3-YL-1H-PYRROLE- 2,5-DICARBOXYLIC ACID	A	2Z3U	0.72
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PC2	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B,C,D	1ARZ	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PE7	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A	2PES	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1C3V	0.75
PDC	PYRIDINE-2,6-DICARBOXYLIC ACID	A,B	1P9L	0.75
PYB	4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID	A,D,E,G,I,J	1S32	0.74
PYB	4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID	D,I,J	1M18	0.74
PYB	4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID	E,I,J	1M1A	0.74
PYB	4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID	E,I,J	1M19	0.74
IDA	(2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO- INDOL-7-YL)ACETIC ACID	A,B	1OXL	0.7
PBG	3-[5-(AMINOMETHYL)-4-(CARBOXYMETHYL)- 1H-PYRROL-3-YL]PROPANOIC ACID	A,B	1E51	0.7
PBG	3-[5-(AMINOMETHYL)-4-(CARBOXYMETHYL)- 1H-PYRROL-3-YL]PROPANOIC ACID	A	1OHL	0.7
LBV		A	2O9B	0.7
LBV		A,B	2OOL	0.7
LBV		A	2O9C	0.7
FIC	5-fluoroindole-2-carboxylic acid	A,B	3DWS	0.83
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CQ1	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1OTW	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1C9U	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1W6S	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1FLG	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A	1KV9	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD6	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,B	1CRU	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1H4I	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD7	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C	2AD8	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,D,I	2D0V	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C	4AAH	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C,E,G	1H4J	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A	1KB0	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A	1YIQ	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1LRW	0.76
PQQ	PYRROLOQUINOLINE QUINONE	A,C	1G72	0.76