MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03922900

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
DLS	DI-ACETYL-LYSINE	A,B,C,D,E,F	1FVM	0.8
DAA	8-AMINO-7-CARBOXYAMINO-NONANOIC ACID WITH ALUMINUM FLUORIDE	A	1BS1	0.71
6HN	6-nitro-L-norleucine	A,B	3F80	0.71
ACA	6-AMINOHEXANOIC ACID	A,B	2JT9	0.73
ACA	6-AMINOHEXANOIC ACID	A,B	1CEA	0.73
ACA	6-AMINOHEXANOIC ACID	C	1ILP	0.73
ACA	6-AMINOHEXANOIC ACID	A	2PK4	0.73
ACA	6-AMINOHEXANOIC ACID	1,2,4,5,A,B, C,D,E,J,K,L, M,N,O,P,R,S, T,U,V,Z	1M90	0.73
ACA	6-AMINOHEXANOIC ACID	0,1,3,4,5,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z	1VQ6	0.73
ACA	6-AMINOHEXANOIC ACID	0,2,4,9,A,B, C,H,I,J,K,L, M,N,P,Q,R,S, T,X,Y,Z	1KQS	0.73
ACA	6-AMINOHEXANOIC ACID	A	1PK2	0.73
ACA	6-AMINOHEXANOIC ACID	A	2ZM7	0.73
ACA	6-AMINOHEXANOIC ACID	0,1,2,3,6,9, A,B,C,D,F,H, J,K,L,M,N,O, Q,R,S,T,U,Y,Z	3CMA	0.73
ACA	6-AMINOHEXANOIC ACID	C	1ILQ	0.73
ACA	6-AMINOHEXANOIC ACID	A	2ZM8	0.73
ACA	6-AMINOHEXANOIC ACID	0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z	1VQK	0.73
ACA	6-AMINOHEXANOIC ACID	A	2DCF	0.73
ACA	6-AMINOHEXANOIC ACID	A	1HPK	0.73
ACA	6-AMINOHEXANOIC ACID	0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z	1VQ8	0.73
ACA	6-AMINOHEXANOIC ACID	0,1,2,3,6,9, A,B,C,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z	3CME	0.73
ACA	6-AMINOHEXANOIC ACID	A	2ZM9	0.73
ACA	6-AMINOHEXANOIC ACID	0,1,2,3,4,5, 9,A,B,C,D,F, H,J,K,L,M,N, O,Q,R,S,T,U, Y,Z	1VQN	0.73
ACA	6-AMINOHEXANOIC ACID	A	2ZMA	0.73
ACA	6-AMINOHEXANOIC ACID	A	3KIV	0.73
ACA	6-AMINOHEXANOIC ACID	0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z	1VQ9	0.73
CLH	2-AMINO-6-[2-(2-OXO-ACETYLAMINO)- ACETYLAMINO]-HEXANOIC ACID	A,B	1K09	0.72
AGM	5-METHYL-ARGININE	A,B,C,D,E,F	1HBO	0.74
AGM	5-METHYL-ARGININE	A,C,D,F	1MRO	0.74
AGM	5-METHYL-ARGININE	A,C,D,F	1E6Y	0.74
AGM	5-METHYL-ARGININE	A,B,C,D,E,F	1HBM	0.74
AGM	5-METHYL-ARGININE	A,B,C,D,E,F	1HBN	0.74
AGM	5-METHYL-ARGININE	A,B,C,D,E,F	1HBU	0.74
AHP	2-AMINO-HEPTANOIC ACID	D	1J4X	0.78
AB5	2(S)-AMINO-6-BORONOHEXANOIC ACID	A,B	2AEB	0.81
CPI	6-CARBOXYPIPERIDINE	A,B,C,D,F,Q	1EFR	0.79
CPI	6-CARBOXYPIPERIDINE	B	1EOL	0.79
CPI	6-CARBOXYPIPERIDINE	B	1EOJ	0.79
CPI	6-CARBOXYPIPERIDINE	A,B,C,D,E,F, G,H,I,J,K,L	1W3M	0.79
CPI	6-CARBOXYPIPERIDINE	A,B	2ITK	0.79
CPI	6-CARBOXYPIPERIDINE	A,B	2Q5A	0.79
6CL	6-CARBOXYLYSINE	U	2AIZ	0.76
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A	3C3G	0.73
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A,B,C	2OXJ	0.73
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A,B,C,D	3C3F	0.73
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A,B,C	3HEZ	0.73
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A	2OXK	0.73
API	2,6-DIAMINOPIMELIC ACID	A,B	1E8C	0.76
API	2,6-DIAMINOPIMELIC ACID	A	2DAP	0.76
API	2,6-DIAMINOPIMELIC ACID	E,S	148L	0.76
CCL	N~6~-[(CYCLOPENTYLOXY)CARBONYL]- D-LYSINE	A	2Q7G	0.72
ABH	2(S)-AMINO-6-BORONOHEXANOIC ACID	A,B	1D3V	0.79
ABH	2(S)-AMINO-6-BORONOHEXANOIC ACID	A,B	2PLL	0.79
ABH	2(S)-AMINO-6-BORONOHEXANOIC ACID	A,B	3E6K	0.79
ABH	2(S)-AMINO-6-BORONOHEXANOIC ACID	A,B	3E6V	0.79
AOR	N~2~-ACETYL-L-ORNITHINE	A	1ZQ6	0.73
AN0	N-ACETYL-L-NORVALINE	C,D,E,X,Y,Z	2G7M	0.72
AN0	N-ACETYL-L-NORVALINE	A	1ZQ8	0.72
B3Q	(3S)-3,6-diamino-6-oxohexanoic acid	A,B,C	3HEZ	0.71
B3Q	(3S)-3,6-diamino-6-oxohexanoic acid	A	3C3G	0.71
CIR	CITRULLINE	A,B,C,D	1J21	0.72
CIR	CITRULLINE	B	1KOD	0.72
CIR	CITRULLINE	A,B,C	3B3I	0.72
CIR	CITRULLINE	C	3DTX	0.72
CIR	CITRULLINE	A	2C6Z	0.72
CIR	CITRULLINE	A,C,E,F	2W65	0.72
CIR	CITRULLINE	A,B	2JAI	0.72
CIR	CITRULLINE	P	3FT2	0.72
CIR	CITRULLINE	A,B,C,D	1J1Z	0.72
CIR	CITRULLINE	A,B	1LXY	0.72
CIR	CITRULLINE	F,H	1OL1	0.72
CIR	CITRULLINE	A	1KP3	0.72
CIR	CITRULLINE	A	2NZ2	0.72
CIR	CITRULLINE	A	1H70	0.72
CIR	CITRULLINE	A	1K97	0.72
CIR	CITRULLINE	C	3B6S	0.72
DDO	6-HYDROXY-D-NORLEUCINE	A,B,C,D	1JSL	0.73
ALY	N(6)-ACETYLLYSINE	A,B	2B4D	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2OD9	0.84
ALY	N(6)-ACETYLLYSINE	A,B,C,P,Q	2DVR	0.84
ALY	N(6)-ACETYLLYSINE	A,B,C,P,Q	2DVS	0.84
ALY	N(6)-ACETYLLYSINE	A,B,C,P,Q	2DVQ	0.84
ALY	N(6)-ACETYLLYSINE	A,B,C,D	2OT7	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2B5G	0.84
ALY	N(6)-ACETYLLYSINE	A	2GIV	0.84
ALY	N(6)-ACETYLLYSINE	B	2RNY	0.84
ALY	N(6)-ACETYLLYSINE	A	1JSP	0.84
ALY	N(6)-ACETYLLYSINE	A,B,I,L	2V5W	0.84
ALY	N(6)-ACETYLLYSINE	A,D	3D4B	0.84
ALY	N(6)-ACETYLLYSINE	A,B,C,D	2OQ6	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2R0Y	0.84
ALY	N(6)-ACETYLLYSINE	A	3CZ7	0.84
ALY	N(6)-ACETYLLYSINE	A	1JM4	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2H4H	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2J6V	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2R10	0.84
ALY	N(6)-ACETYLLYSINE	A,B	1YC5	0.84
ALY	N(6)-ACETYLLYSINE	A,B,C,D	2OX0	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2H2G	0.84
ALY	N(6)-ACETYLLYSINE	A,D	2H4F	0.84
ALY	N(6)-ACETYLLYSINE	A	2OU2	0.84
ALY	N(6)-ACETYLLYSINE	A,B	1S5P	0.84
ALY	N(6)-ACETYLLYSINE	B	2RNW	0.84
ALY	N(6)-ACETYLLYSINE	A	3D35	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2OD2	0.84
ALY	N(6)-ACETYLLYSINE	A	2ZFN	0.84
ALY	N(6)-ACETYLLYSINE	C,D	2C1J	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2QQG	0.84
ALY	N(6)-ACETYLLYSINE	B	2RNX	0.84
ALY	N(6)-ACETYLLYSINE	A,B	1MA3	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2H2H	0.84
ALY	N(6)-ACETYLLYSINE	A	2I2Z	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2OD7	0.84
ALY	N(6)-ACETYLLYSINE	P	1E6I	0.84
ALY	N(6)-ACETYLLYSINE	A,B	1SZC	0.84
ALY	N(6)-ACETYLLYSINE	A,B,C,D,I,J, K,L	3EWF	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2H2D	0.84
ALY	N(6)-ACETYLLYSINE	A,B	1Q1A	0.84
ALY	N(6)-ACETYLLYSINE	A,B	1SZD	0.84
ALY	N(6)-ACETYLLYSINE	Q,R	2E3K	0.84
ALY	N(6)-ACETYLLYSINE	A	2OZU	0.84
ALY	N(6)-ACETYLLYSINE	A,B	2QQF	0.84
ALY	N(6)-ACETYLLYSINE	A,B,C	2R0V	0.84