MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02865740

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
CHF	CYCLOHEXYLFLUOROSTATONE	E	1EPR	0.73
CHF	CYCLOHEXYLFLUOROSTATONE	A,B	1OD1	0.73
CHF	CYCLOHEXYLFLUOROSTATONE	A,I	2JXR	0.73
CHF	CYCLOHEXYLFLUOROSTATONE	A,B	2VS2	0.73
CHF	CYCLOHEXYLFLUOROSTATONE	I	1EPO	0.73
CHF	CYCLOHEXYLFLUOROSTATONE	A,B	2JJJ	0.73
CHF	CYCLOHEXYLFLUOROSTATONE	A,B	2JJI	0.73
AHP	2-AMINO-HEPTANOIC ACID	D	1J4X	0.71
NOR	CYCLOHEXYL-NORSTATINE	E,I	1EPN	0.71
NOR	CYCLOHEXYL-NORSTATINE	P	1CZI	0.71
NOR	CYCLOHEXYL-NORSTATINE	A,I	1GVT	0.71
KAP	7-KETO-8-AMINOPELARGONIC ACID	A,B	1QJ3	0.72
KAP	7-KETO-8-AMINOPELARGONIC ACID	A,B,C,D	3FMI	0.72
KAP	7-KETO-8-AMINOPELARGONIC ACID	A,B	3DU4	0.72
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	A	1FQ7	0.72
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	I	4ER1	0.72
CAL	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOBUTYL-HEXANOIC ACID	I	3ER3	0.72
NLH	(2R,5S)-5-amino-2-butyl-4,4-dihydroxynonanoic acid	A,B,I	3DCR	0.72
ZDP	(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A,B,C,D,E,F	3EJX	0.77
ZDP	(2S,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A	2GKE	0.77
DNN	7,8-DIAMINO-NONANOIC ACID	A	1DAH	0.73
DNN	7,8-DIAMINO-NONANOIC ACID	A	1A82	0.73
IKT	3-(1-AMINOETHYL)NONANEDIOIC ACID	A	1DAE	0.76
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2COJ	0.73
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B,C	2EJ3	0.73
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2A1H	0.73
GBN	[1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID	A,B	2COI	0.73
NLK	(2R,5S)-5-amino-2-butyl-4-oxononanoic acid	A,B,I	3DCK	0.72
6CL	6-CARBOXYLYSINE	U	2AIZ	0.73
API	2,6-DIAMINOPIMELIC ACID	A,B	1E8C	0.73
API	2,6-DIAMINOPIMELIC ACID	A	2DAP	0.73
API	2,6-DIAMINOPIMELIC ACID	E,S	148L	0.73
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	1E80	0.74
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	1EED	0.74
CHS	4-AMINO-5-CYCLOHEXYL-3-HYDROXY- PENTANOIC ACID	I	2ER0	0.74
HHK	(2S)-2,8-DIAMINOOCTANOIC ACID	A	1XY8	0.78
CPV	5-AMINO-6-CYCLOHEXYL-4-HYDROXY- 2-ISOPROPYL-HEXANOIC ACID	I	1IVQ	0.71
NPI	2-AMINOPIMELIC ACID	A	2TDT	0.71
NPI	2-AMINOPIMELIC ACID	A	1KGQ	0.71
ZAL	3-cyclohexyl-D-alanine	I	1HBT	0.88
MNL	4,N-DIMETHYLNORLEUCINE	C	1CWC	0.71
DOA	12-AMINO-DODECANOIC ACID	B	1EOJ	0.71
DOA	12-AMINO-DODECANOIC ACID	A,D	1H8T	0.71
DOA	12-AMINO-DODECANOIC ACID	A	2DCX	0.71
DOA	12-AMINO-DODECANOIC ACID	B	1EOL	0.71
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5Z	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	5GDS	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2A2X	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FEQ	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,P	2ANK	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,C,D	3DPP	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1EB1	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1NZQ	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1HBT	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D6E	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B	1B3H	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	2FES	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	C,D,E,G,H	3DPQ	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1THS	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	I	1QUR	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D	3DPO	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	H,I	4THN	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,D	1D5M	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D,H	1O0D	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P	1YWH	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	A	1XRZ	0.88
ALC	2-AMINO-3-CYCLOHEXYL-PROPIONIC ACID	D	1D5X	0.88
CFS	4-AMINO-5-CYCLOHEXYL-2,2-DIFLUORO- 3-HYDROXY-PENTANOIC ACID	A	1FQ8	0.7
LPL	LEU-HYDROXYETHYLENE-LEU	B,D,F,H	1SMR	0.71
ZDR	(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A,B,C,D,E,F	3EKM	0.77
ZDR	(2R,6S)-2,6-DIAMINO-2-METHYLHEPTANEDIOIC ACID	A	2GKJ	0.77
CHG	CYCLOHEXYL-GLYCINE	2,3,4	8KME	0.86
CHG	CYCLOHEXYL-GLYCINE	H,I	4THN	0.86
CHG	CYCLOHEXYL-GLYCINE	H,I,J	7KME	0.86
CHG	CYCLOHEXYL-GLYCINE	H,I	5GDS	0.86
PB1	3-(2-AMINOETHYL)-4-(AMINOMETHYL)HEPTANEDIOIC ACID	A,B	1PV8	0.75
AMH	TRANS-4-AMINOMETHYLCYCLOHEXANE- 1-CARBOXYLIC ACID	A,B	1CEB	0.8
AMH	TRANS-4-AMINOMETHYLCYCLOHEXANE- 1-CARBOXYLIC ACID	A	1B2I	0.8
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A	3C3G	0.7
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A,B,C	2OXJ	0.7
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A,B,C,D	3C3F	0.7
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A,B,C	3HEZ	0.7
B3K	(3S)-3,7-DIAMINOHEPTANOIC ACID	A	2OXK	0.7