MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02231208

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
REX	GLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL- D-ALANYL-D-ALANINE	A	1IKG	0.76
HTF	N-(2-OXOTETRAHYDROFURAN-3-YL)OCTANAMIDE	A	2AVX	0.73
REY	GLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL- D-ALANINE	A	1IKI	0.77
MCP	2-CARBOXY-4-METHYLPIPERIDINE	H	1ETR	0.73
NSK	N-SUCCINYL LYSINE	A	2P8B	0.7
ACW	D-(L-A-AMINOADIPOYL)-L-CYSTEINYL- B-METHYL-D-CYCLOPROPYLGLYCINE	B	2IVI	0.71
MNL	4,N-DIMETHYLNORLEUCINE	C	1CWC	0.77
DLS	DI-ACETYL-LYSINE	A,B,C,D,E,F	1FVM	0.75
CHO	GLYCOCHENODEOXYCHOLIC ACID	A,B	1FMC	0.7
CHO	GLYCOCHENODEOXYCHOLIC ACID	A,B	1AHI	0.7
CHO	GLYCOCHENODEOXYCHOLIC ACID	A	2B04	0.7
RE1	GLYCYL-L-A-AMINOPIMELYL-E-(D-2- AMINOETHYL)PHOSPHONATE	A	1MPL	0.73
REZ	(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}- 7-OXOHEPTANOIC ACID	A,B	2J9P	0.79
REZ	(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}- 7-OXOHEPTANOIC ACID	A,B,C,D	2VGK	0.79
BEQ	N-(CARBOXYMETHYL)-N,N-DIMETHYL- 3-[(1-OXODODECYL)AMINO]-1-PROPANAMINIUM INNER SALT	A,B,C,D	1YBK	0.73
AR9	(2R,4S)-N-butyl-4-[(2S,5S,7R)-2,7- dimethyl-3,15-dioxo-1,4-diazacyclopentadecan- 5-yl]-4-hydroxy-2-methylbutanamide	A,B,C	3DV1	0.72
ABX	5-[1-(ACETYLAMINO)-3-METHYLBUTYL]- 4-(METHOXYCARBONYL)PROLINE	A	1XOE	0.71
IKT	3-(1-AMINOETHYL)NONANEDIOIC ACID	A	1DAE	0.7
GCH	GLYCOCHOLIC ACID	A	2B00	0.7
GCH	GLYCOCHOLIC ACID	A	1EIO	0.7
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
140	N-PALMITOYLGLYCINE	A,B	1JPZ	0.74
140	N-PALMITOYLGLYCINE	A,B	1ZOA	0.74
140	N-PALMITOYLGLYCINE	A,B	3CBD	0.74
O12	N~5~-dodecanoyl-L-ornithine	A,B,C,D,E,F, G,H,I,J,K,L	3CAY	0.71
O12	N~5~-dodecanoyl-L-ornithine	A,B,C,D,E,F, G,H,I,J,K,L	3CBA	0.71
ALY	N(6)-ACETYLLYSINE	A,B	2B4D	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2OD9	0.74
ALY	N(6)-ACETYLLYSINE	A,B,C,P,Q	2DVR	0.74
ALY	N(6)-ACETYLLYSINE	A,B,C,P,Q	2DVS	0.74
ALY	N(6)-ACETYLLYSINE	A,B,C,P,Q	2DVQ	0.74
ALY	N(6)-ACETYLLYSINE	A,B,C,D	2OT7	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2B5G	0.74
ALY	N(6)-ACETYLLYSINE	A	2GIV	0.74
ALY	N(6)-ACETYLLYSINE	B	2RNY	0.74
ALY	N(6)-ACETYLLYSINE	A	1JSP	0.74
ALY	N(6)-ACETYLLYSINE	A,B,I,L	2V5W	0.74
ALY	N(6)-ACETYLLYSINE	A,D	3D4B	0.74
ALY	N(6)-ACETYLLYSINE	A,B,C,D	2OQ6	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2R0Y	0.74
ALY	N(6)-ACETYLLYSINE	A	3CZ7	0.74
ALY	N(6)-ACETYLLYSINE	A	1JM4	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2H4H	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2J6V	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2R10	0.74
ALY	N(6)-ACETYLLYSINE	A,B	1YC5	0.74
ALY	N(6)-ACETYLLYSINE	A,B,C,D	2OX0	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2H2G	0.74
ALY	N(6)-ACETYLLYSINE	A,D	2H4F	0.74
ALY	N(6)-ACETYLLYSINE	A	2OU2	0.74
ALY	N(6)-ACETYLLYSINE	A,B	1S5P	0.74
ALY	N(6)-ACETYLLYSINE	B	2RNW	0.74
ALY	N(6)-ACETYLLYSINE	A	3D35	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2OD2	0.74
ALY	N(6)-ACETYLLYSINE	A	2ZFN	0.74
ALY	N(6)-ACETYLLYSINE	C,D	2C1J	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2QQG	0.74
ALY	N(6)-ACETYLLYSINE	B	2RNX	0.74
ALY	N(6)-ACETYLLYSINE	A,B	1MA3	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2H2H	0.74
ALY	N(6)-ACETYLLYSINE	A	2I2Z	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2OD7	0.74
ALY	N(6)-ACETYLLYSINE	P	1E6I	0.74
ALY	N(6)-ACETYLLYSINE	A,B	1SZC	0.74
ALY	N(6)-ACETYLLYSINE	A,B,C,D,I,J, K,L	3EWF	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2H2D	0.74
ALY	N(6)-ACETYLLYSINE	A,B	1Q1A	0.74
ALY	N(6)-ACETYLLYSINE	A,B	1SZD	0.74
ALY	N(6)-ACETYLLYSINE	Q,R	2E3K	0.74
ALY	N(6)-ACETYLLYSINE	A	2OZU	0.74
ALY	N(6)-ACETYLLYSINE	A,B	2QQF	0.74
ALY	N(6)-ACETYLLYSINE	A,B,C	2R0V	0.74