MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00482241

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
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2EIL	0.73
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z	2DYR	0.73
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2EIM	0.73
SAC	N-ACETYL-SERINE	A	1R4U	0.73
SAC	N-ACETYL-SERINE	A,B,C,D	1WS3	0.73
SAC	N-ACETYL-SERINE	A,B,C,D,E,F, G,H	1XY3	0.73
SAC	N-ACETYL-SERINE	A,B	1EVU	0.73
SAC	N-ACETYL-SERINE	A,B,C,D,E,F, G,H	1R56	0.73
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z	2DYS	0.73
SAC	N-ACETYL-SERINE	A	1WRR	0.73
SAC	N-ACETYL-SERINE	A,B,C,D,E,F, G,I,J,L,M,N, O,P,Q,S,T,V, W,Z	1V54	0.73
SAC	N-ACETYL-SERINE	A,B	3CVQ	0.73
SAC	N-ACETYL-SERINE	A	1B0B	0.73
SAC	N-ACETYL-SERINE	A	1XT4	0.73
SAC	N-ACETYL-SERINE	A,B,C,F,G,I, J,L,M,N,O,P, S,T,V,W,Z	2EIJ	0.73
SAC	N-ACETYL-SERINE	A	2FXL	0.73
SAC	N-ACETYL-SERINE	A	1R4S	0.73
SAC	N-ACETYL-SERINE	A,B,C,D	1WS2	0.73
SAC	N-ACETYL-SERINE	A,B,C,D	2AUC	0.73
SAC	N-ACETYL-SERINE	A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Y,Z	2EIN	0.73
SAC	N-ACETYL-SERINE	A	1R51	0.73
SAC	N-ACETYL-SERINE	A,B,C,E,F,G, I,J,M,N,O,P, Q,S,T,V,W,Z	1V55	0.73
SAC	N-ACETYL-SERINE	A,B,C,D	1XXJ	0.73
SAC	N-ACETYL-SERINE	T	2QAC	0.73
SAC	N-ACETYL-SERINE	A,B,C,E,F,G, I,J,L,M,N,O, P,Q,S,T,V,W, Y,Z	2EIK	0.73
SYS	3-[(2-amino-2-oxoethyl)selanyl]- L-alanine	A,B,C,D	3BOG	0.71
AAC	ACETYLAMINO-ACETIC ACID	A,B	1NG3	0.83
AAC	ACETYLAMINO-ACETIC ACID	A	1QD8	0.83
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	1OEX	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A	2OWX	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVW	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVX	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A	2OWW	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	1GKT	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A	2OWC	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVV	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVT	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	2VS2	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A	1OEW	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,I	1GVU	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	2JJJ	0.75
SUI	(3-AMINO-2,5-DIOXO-1-PYRROLIDINYL)ACETIC ACID	A,B	2JJI	0.75
AYA	N-ACETYLALANINE	A	1D0W	0.84
AYA	N-ACETYLALANINE	A	1AH4	0.84
AYA	N-ACETYLALANINE	A,B	1VBP	0.84
AYA	N-ACETYLALANINE	A,B,C,D,E,F, G,H	1J4T	0.84
AYA	N-ACETYLALANINE	A,B,C,D	1OUW	0.84
AYA	N-ACETYLALANINE	A	1AH3	0.84
AYA	N-ACETYLALANINE	A	1EKO	0.84
AYA	N-ACETYLALANINE	B,D,F,H	2V4I	0.84
AYA	N-ACETYLALANINE	A,B,C,D,E,F, G,H	1VBO	0.84
AYA	N-ACETYLALANINE	A,B,C,D	1J4U	0.84
CMS	CARBAMOYL SARCOSINE	A,B	1CHM	0.7
THC	N-METHYLCARBONYLTHREONINE	A,B,C	1A7C	0.7
THC	N-METHYLCARBONYLTHREONINE	B	2HR0	0.7
THC	N-METHYLCARBONYLTHREONINE	L,P	2MPA	0.7
THC	N-METHYLCARBONYLTHREONINE	L,P	1MPA	0.7
MAA	N-METHYLALANINE	A,B	1A7Z	0.73
MAA	N-METHYLALANINE	A,B	2VSL	0.73
MAA	N-METHYLALANINE	C	1CWI	0.73
MAA	N-METHYLALANINE	C,F,G,H	3DW8	0.73
MAA	N-METHYLALANINE	A,B,C,D,E,F, G,H	2NYL	0.73
MAA	N-METHYLALANINE	D	1D5X	0.73
MAA	N-METHYLALANINE	C	1PYW	0.73
MAA	N-METHYLALANINE	A,B,C,D,E,F, G,H	2NYM	0.73
MAA	N-METHYLALANINE	C,I	2IE3	0.73
MAA	N-METHYLALANINE	C,F,X,Y	2NPP	0.73
NCB	N-CARBAMOYL-ALANINE	A,B,C,D,E,F, G,H,I,J	1QMV	0.77
AN0	N-ACETYL-L-NORVALINE	C,D,E,X,Y,Z	2G7M	0.76
AN0	N-ACETYL-L-NORVALINE	A	1ZQ8	0.76
SC2	N-ACETYL-L-CYSTEINE	A,B,C,D,E,F, G,H	2J58	0.75
SC2	N-ACETYL-L-CYSTEINE	A,B,C,D,E,F	2J2P	0.75
SC2	N-ACETYL-L-CYSTEINE	B,C,D,E,F	2J1G	0.75
NXA	N-CARBOXYALANINE	A	2IUX	0.75
NXA	N-CARBOXYALANINE	A	1O8A	0.75
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z26	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	1J79	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	1XGE	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z29	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B,G,H	1R0C	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z27	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z28	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z2A	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z24	0.72
NCD	N-CARBAMOYL-L-ASPARTATE	A,B	2Z25	0.72
MEN	N-METHYL ASPARAGINE	A,B,K,L	1B8D	0.73
MEN	N-METHYL ASPARAGINE	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	0.73
MEN	N-METHYL ASPARAGINE	A,B,C,D	1XF6	0.73
MEN	N-METHYL ASPARAGINE	A,B,C,D,E,F, H,I,J,K,L,M	1B33	0.73
MEN	N-METHYL ASPARAGINE	A,B	1I7Y	0.73
MEN	N-METHYL ASPARAGINE	A,B	3BRP	0.73
MEN	N-METHYL ASPARAGINE	A,B	1JBO	0.73
MEN	N-METHYL ASPARAGINE	A,B	1ALL	0.73
MEN	N-METHYL ASPARAGINE	A,B,K,L	1EYX	0.73
MEN	N-METHYL ASPARAGINE	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	0.73
MEN	N-METHYL ASPARAGINE	A,B,C,D	2VJH	0.73
MEN	N-METHYL ASPARAGINE	A,B	1KTP	0.73
MEN	N-METHYL ASPARAGINE	A,B	1PHN	0.73
MEN	N-METHYL ASPARAGINE	A,B,C,D	1QGW	0.73
MEN	N-METHYL ASPARAGINE	A,B,C,D	1XG0	0.73
MEN	N-METHYL ASPARAGINE	A,B	2VJT	0.73
MEN	N-METHYL ASPARAGINE	A,B,C,D,E,F, K,L,M,N,O,P	2BV8	0.73
MEN	N-METHYL ASPARAGINE	A,B	2V8A	0.73
MEN	N-METHYL ASPARAGINE	A,B,C,D,E,F, G,H	3DBJ	0.73
CL5	N-(3-OXOPROPYL)GLYCINE	A	2IOT	0.8
175	3,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL- 4-ON	A,B,C,D,E,F, G,H	1T6P	0.73
175	3,5-DIHYDRO-5-METHYLIDENE-4H-IMIDAZOL- 4-ON	A,B	1T6J	0.73
AME	N-ACETYLMETHIONINE	A,B,C,D	1SJA	0.71
AME	N-ACETYLMETHIONINE	A,B	2J4Y	0.71
DMH	N4,N4-DIMETHYL-ASPARAGINE	E,F,G,H	1NKK	0.7
DMH	N4,N4-DIMETHYL-ASPARAGINE	A,B,C,D,E,F, G,H	1NJT	0.7
DMH	N4,N4-DIMETHYL-ASPARAGINE	E,F,G,H	1NJU	0.7
DMH	N4,N4-DIMETHYL-ASPARAGINE	Y,Z	1JQ7	0.7
DMH	N4,N4-DIMETHYL-ASPARAGINE	C	1NKM	0.7
URP	N-(AMINOCARBONYL)-BETA-ALANINE	A,B,C,D	2V8V	0.76
URP	N-(AMINOCARBONYL)-BETA-ALANINE	A,B,C,D	2FVM	0.76
URP	N-(AMINOCARBONYL)-BETA-ALANINE	A,B,C,D	2V8H	0.76
193	(2S)-4-(BETA-ALANYLAMINO)-2-AMINOBUTANOIC ACID	A	1XY5	0.81
MHA	(CARBAMOYLMETHYL-CARBOXYMETHYL- AMINO)-ACETIC ACID	A,B	2IXX	0.73
MHA	(CARBAMOYLMETHYL-CARBOXYMETHYL- AMINO)-ACETIC ACID	A,B	1IX1	0.73
140	N-PALMITOYLGLYCINE	A,B	1JPZ	0.7
140	N-PALMITOYLGLYCINE	A,B	1ZOA	0.7
140	N-PALMITOYLGLYCINE	A,B	3CBD	0.7
I38	N-(3-MERCAPTOPROPANOYL)-D-ALANINE	A	2QDT	0.76
CDV	3-METHYL-2-UREIDO-BUTYRIC ACID	B	1UF7	0.72
NMC	N-CYCLOPROPYLMETHYL GLYCINE	C,D	3SEM	0.74
IPG	N-ISOPROPYL GLYCINE	C,D	2SEM	0.75
AOR	N~2~-ACETYL-L-ORNITHINE	A	1ZQ6	0.74
1IP	N~2~-(PHOSPHONOACETYL)-L-ASPARAGINE	A,B,C,D	2IPO	0.71
OGA	N-OXALYOLGLYCINE	A,B,C,D	2OQ6	0.77
OGA	N-OXALYOLGLYCINE	A	2RDS	0.77
OGA	N-OXALYOLGLYCINE	A	1H2M	0.77
OGA	N-OXALYOLGLYCINE	A	2QRL	0.77
OGA	N-OXALYOLGLYCINE	A,B,C,D	2OX0	0.77
OGA	N-OXALYOLGLYCINE	A	2RDR	0.77
OGA	N-OXALYOLGLYCINE	A,B,C,D	2OS2	0.77
OGA	N-OXALYOLGLYCINE	A,B,I,J	2PXJ	0.77
OGA	N-OXALYOLGLYCINE	A,B,F,G	2Q8E	0.77
OGA	N-OXALYOLGLYCINE	A,B,I,J	2P5B	0.77
OGA	N-OXALYOLGLYCINE	A	1H2K	0.77
OGA	N-OXALYOLGLYCINE	A,B,C,D	2OT7	0.77
OGA	N-OXALYOLGLYCINE	A,B	2OQ7	0.77