MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03250521

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
SHR	N-(5-AMINO-5-CARBOXYPENTYL)GLUTAMIC ACID	A,B,C,D,E,F, G,H	1E5Q	0.85
MLE	N-METHYLLEUCINE	A,D	2J9A	0.75
MLE	N-METHYLLEUCINE	C	1IKF	0.75
MLE	N-METHYLLEUCINE	A,M,N	2Z6W	0.75
MLE	N-METHYLLEUCINE	B,D,F,H,J,L, N,P	1C5F	0.75
MLE	N-METHYLLEUCINE	D,E,F	1XQ7	0.75
MLE	N-METHYLLEUCINE	C	1CWA	0.75
MLE	N-METHYLLEUCINE	C	1CWF	0.75
MLE	N-METHYLLEUCINE	B,D,F,H,J,L, N,P,R,T	2RMB	0.75
MLE	N-METHYLLEUCINE	B	3CYS	0.75
MLE	N-METHYLLEUCINE	C	1CWH	0.75
MLE	N-METHYLLEUCINE	A,B,C,D,E,F, G,H	3BO7	0.75
MLE	N-METHYLLEUCINE	C	1CYN	0.75
MLE	N-METHYLLEUCINE	A	1LV9	0.75
MLE	N-METHYLLEUCINE	C,D	2OJU	0.75
MLE	N-METHYLLEUCINE	B,D,F,H,J,L, N,P,R,T	2RMA	0.75
MLE	N-METHYLLEUCINE	A	1IKM	0.75
MLE	N-METHYLLEUCINE	C	1CWK	0.75
MLE	N-METHYLLEUCINE	A,B	2HG8	0.75
MLE	N-METHYLLEUCINE	C	1CWB	0.75
MLE	N-METHYLLEUCINE	C	1CWJ	0.75
MLE	N-METHYLLEUCINE	A	1CYB	0.75
MLE	N-METHYLLEUCINE	D	1QNG	0.75
MLE	N-METHYLLEUCINE	B	1MIK	0.75
MLE	N-METHYLLEUCINE	A	1CSA	0.75
MLE	N-METHYLLEUCINE	C	1CWL	0.75
MLE	N-METHYLLEUCINE	A	1CYA	0.75
MLE	N-METHYLLEUCINE	A,B,D	1MF8	0.75
MLE	N-METHYLLEUCINE	C	1BCK	0.75
MLE	N-METHYLLEUCINE	A,B,D,E,F,H	1M63	0.75
MLE	N-METHYLLEUCINE	C	1CWC	0.75
MLE	N-METHYLLEUCINE	C	1CWI	0.75
MLE	N-METHYLLEUCINE	C,D	1QNH	0.75
MLE	N-METHYLLEUCINE	B,D,F,H	2RMC	0.75
MLE	N-METHYLLEUCINE	C	1CWM	0.75
MLE	N-METHYLLEUCINE	T,U,V	2POY	0.75
MLE	N-METHYLLEUCINE	A,B,C,D,E,F, I,J,K,L,M,N	2ESL	0.75
MLE	N-METHYLLEUCINE	C	1CWO	0.75
MLE	N-METHYLLEUCINE	A	1IKL	0.75
NSK	N-SUCCINYL LYSINE	A	2P8B	0.74
LDH	N~6~-ETHYL-L-LYSINE	A,K	2IOF	0.72
MN1	4-CARBOXYPIPERIDINE	N	1NLO	0.74
MN1	4-CARBOXYPIPERIDINE	N	1NLP	0.74
SYM	2S,4R-4-METHYLGLUTAMATE	A,B	1SD3	0.75
2CG	(1R,2R)-3-[(S)-amino(carboxy)methyl]cyclopropane- 1,2-dicarboxylic acid	A,B	2E4V	0.73
OIC	OCTAHYDROINDOLE-2-CARBOXYLIC ACID	B,C	3BV9	0.72
OIC	OCTAHYDROINDOLE-2-CARBOXYLIC ACID	A	1BDK	0.72
TMD	(6,7-DIHYDRO)4-[(E)-BUTENYL]-4,N- DIMETHYL-THREONINE	C	1CWK	0.7
NLG	N-ACETYL-L-GLUTAMATE	A	1OH9	0.75
NLG	N-ACETYL-L-GLUTAMATE	A	1OHA	0.75
NLG	N-ACETYL-L-GLUTAMATE	A,B,C,D,E,F, G,H,I,J,K,L	2BUF	0.75
NLG	N-ACETYL-L-GLUTAMATE	A,B,C,D	2RD5	0.75
NLG	N-ACETYL-L-GLUTAMATE	A,B	2JJ4	0.75
NLG	N-ACETYL-L-GLUTAMATE	A,B,C,D,E,F, G,H,J,K	2V5H	0.75
NLG	N-ACETYL-L-GLUTAMATE	A	1GSJ	0.75
NLG	N-ACETYL-L-GLUTAMATE	A	3B8G	0.75
NLG	N-ACETYL-L-GLUTAMATE	A	1GS5	0.75
NLG	N-ACETYL-L-GLUTAMATE	A,B,C	2BTY	0.75
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1P1N	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1LBB	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C34	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1XHY	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	2ANJ	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C32	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1FTK	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1GR2	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	1TT1	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1FW0	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C35	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C36	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C33	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C31	0.77
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	3EN3	0.77
DNM	N-METHYL-D-NORLEUCINE	A,B	1S1O	0.75
DNM	N-METHYL-D-NORLEUCINE	A,B	1S4A	0.75
DNM	N-METHYL-D-NORLEUCINE	A	1R9V	0.75
MCP	2-CARBOXY-4-METHYLPIPERIDINE	H	1ETR	0.88
DLS	DI-ACETYL-LYSINE	A,B,C,D,E,F	1FVM	0.73
IML	N-METHYL-ISOLEUCINE	C	1CWM	0.75
MCL	NZ-(1-CARBOXYETHYL)-LYSINE	A,B	1O5K	0.77
MCL	NZ-(1-CARBOXYETHYL)-LYSINE	A,B	3CPR	0.77
MCL	NZ-(1-CARBOXYETHYL)-LYSINE	A,B	2VC6	0.77
MEG	(2S,3R)-3-METHYL-GLUTAMIC ACID	A	1T5N	0.75
MEG	(2S,3R)-3-METHYL-GLUTAMIC ACID	A	1T5M	0.75
LLY	NZ-(DICARBOXYMETHYL)LYSINE	A,B	1UCW	0.74
MNL	4,N-DIMETHYLNORLEUCINE	C	1CWC	0.82
CYJ	(Z)-N~6~-[(4R,5S)-5-(2-CARBOXYETHYL)- 4-(CARBOXYMETHYL)PIPERIDIN-3-YLIDENE]- L-LYSINE	A,B	2C14	0.71
ZAL	3-cyclohexyl-D-alanine	I	1HBT	0.71
CPI	6-CARBOXYPIPERIDINE	A,B,C,D,F,Q	1EFR	0.82
CPI	6-CARBOXYPIPERIDINE	B	1EOL	0.82
CPI	6-CARBOXYPIPERIDINE	B	1EOJ	0.82
CPI	6-CARBOXYPIPERIDINE	A,B,C,D,E,F, G,H,I,J,K,L	1W3M	0.82
CPI	6-CARBOXYPIPERIDINE	A,B	2ITK	0.82
CPI	6-CARBOXYPIPERIDINE	A,B	2Q5A	0.82
NLQ	N~2~-ACETYL-L-GLUTAMINE	A,B,C,D	2GGH	0.7
NLQ	N~2~-ACETYL-L-GLUTAMINE	A,B,C,D	1XPY	0.7
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1Q8H	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WV7	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2EC9	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,H,L,U	2C4F	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	2DPQ	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	L	1PFX	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1Z6J	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1AG7	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	C,H,L,T	2FIR	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1ONU	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2ZZU	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1W2K	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WTG	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C	1TGG	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,I,L,T	2B8O	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1NL1	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WQV	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	2PF2	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1WHE	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WUN	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L,T	2AER	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1ONT	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1WCT	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,G	1IOD	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1W0Y	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1AWY	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	C,H,L	1DAN	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C	1VZM	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2AEI	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	G,L	1NL0	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1AD7	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2ZP0	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1Q3M	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C	1J35	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1P0S	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1WHF	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	2ZWL	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1CFI	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	2O6N	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1MTQ	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L,T	2A2Q	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C	1J34	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	H,L	1WSS	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B,C,D	1LQV	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1MGX	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A,B	2DPR	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	2SPT	0.71
CGU	GAMMA-CARBOXY-GLUTAMIC ACID	A	1NL2	0.71
52A	(2R,4R)-4-aminopyrrolidine-2,4- dicarboxylic acid	A,B	2E4Y	0.73
KGC	N~6~-[(2R)-2-CARBOXY-5-OXOTETRAHYDROFURAN- 2-YL]-L-LYSINE	A,B	2OJP	0.71
KGC	N~6~-[(2R)-2-CARBOXY-5-OXOTETRAHYDROFURAN- 2-YL]-L-LYSINE	A,B	3DEN	0.71
KGC	N~6~-[(2R)-2-CARBOXY-5-OXOTETRAHYDROFURAN- 2-YL]-L-LYSINE	A,B	2PUR	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5Z	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	5GDS	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2A2X	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FEQ	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2ANK	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,C,D	3DPP	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1EB1	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1NZQ	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1HBT	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D6E	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B	1B3H	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FES	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	C,D,E,G,H	3DPQ	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1THS	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1QUR	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D	3DPO	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	4THN	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,D	1D5M	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1O0D	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1YWH	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1XRZ	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5X	0.71
LP6	6-piperidin-1-yl-L-norleucine	A,B	2W7Z	0.75
CHG	CYCLOHEXYL-GLYCINE	2,3,4	8KME	0.72
CHG	CYCLOHEXYL-GLYCINE	H,I	4THN	0.72
CHG	CYCLOHEXYL-GLYCINE	H,I,J	7KME	0.72
CHG	CYCLOHEXYL-GLYCINE	H,I	5GDS	0.72
LYP	N~6~-METHYL-N~6~-PROPYL-L-LYSINE	A,E	2UXN	0.7
LME	(3R)-3-METHYL-L-GLUTAMIC ACID	A	1XT7	0.75
NIG	N-(IMINOMETHYL)-L-GLUTAMIC ACID	A,B	2PUZ	0.7