MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02617332

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
DOQ	(2S,3S,4S)-2-CARBOXY-4-[(1Z,3E,5R)- 5-CARBOXY-1-METHYL-1,3-HEXADIENYL]- 3-PYRROLIDINEACETIC ACID	A,B,C,D,E,F	1YAE	0.81
DOQ	(2S,3S,4S)-2-CARBOXY-4-[(1Z,3E,5R)- 5-CARBOXY-1-METHYL-1,3-HEXADIENYL]- 3-PYRROLIDINEACETIC ACID	A,B	2PBW	0.81
BG4	5-(HYDROXY-METHYL-AMINO)-3-METHYL- PYRROLIDINE-2-CARBOXYLIC ACID	A	1TV3	0.7
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1P1N	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1LBB	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C34	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1XHY	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	2ANJ	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C32	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1FTK	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1GR2	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	1TT1	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	1FW0	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C35	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C36	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C33	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A,B	3C31	0.85
KAI	3-(CARBOXYMETHYL)-4-ISOPROPENYLPROLINE	A	3EN3	0.85
BG5	5-HYDROXYAMINO-3-METHYL-PYRROLIDINE- 2-CARBOXYLIC ACID	A	1TV2	0.72
BGX	4-METHYL-PYRROLINE-5-CARBOXYLIC ACID	A	1L2Q	0.71
BGX	4-METHYL-PYRROLINE-5-CARBOXYLIC ACID	A	1NTH	0.71
TZA	TRANS-AMICLENOMYCIN	A,B	1MLZ	0.73
MCP	2-CARBOXY-4-METHYLPIPERIDINE	H	1ETR	0.75
SSC	(2S,5S)-5-CARBOXYMETHYLPROLINE	A,B,C,D	1Q19	0.71
X7O	5-AMINO-3-METHYL-PYRROLIDINE-2- CARBOXYLIC ACID	A	1L2Q	0.75
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	B	1MIK	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	A	1CSA	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1CWL	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	A	1CYA	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	A,B,D	1MF8	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1BCK	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	A,B,D,E,F,H	1M63	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1CWC	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1CWI	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C,D	1QNH	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	B,D,F,H	2RMC	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	T,U,V	2POY	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1CYN	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C,D	2OJU	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	B,D,F,H,J,L, N,P,R,T	2RMA	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	A	1CYB	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	D	1QNG	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	B	3CYS	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1CWH	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	A,B,C,D,E,F, G,H	3BO7	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	A,B,C,D,E,F, I,J,K,L,M,N	2ESL	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1IKF	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	A,M,N	2Z6W	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	B,D,F,H,J,L, N,P	1C5F	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1CWO	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	D,E,F	1XQ7	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1CWA	0.77
BMT	4-METHYL-4-[(E)-2-BUTENYL]-4,N- METHYL-THREONINE	C	1CWF	0.77
MNL	4,N-DIMETHYLNORLEUCINE	C	1CWC	0.77
DMT	3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)- 6-OCTENOIC ACID	B,D,F,H,J,L, N,P,R,T	2RMB	0.74
DMT	3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)- 6-OCTENOIC ACID	C	1CWB	0.74
ACZ	CIS-AMICLENOMYCIN	A,B	1MLY	0.73
POM	CIS-5-METHYL-4-OXOPROLINE	A,B	1A7Z	0.71
4FB	(4S)-4-FLUORO-L-PROLINE	A	2Q6P	0.73
LYR	N~6~-[(2Z,4E,6E,8E)-3,7-DIMETHYL- 9-(2,6,6-TRIMETHYLCYCLOHEX-1-EN- 1-YL)NONA-2,4,6,8-TETRAENYL]LYSINE	A,B	2J4Y	0.7
OIC	OCTAHYDROINDOLE-2-CARBOXYLIC ACID	B,C	3BV9	0.76
OIC	OCTAHYDROINDOLE-2-CARBOXYLIC ACID	A	1BDK	0.76
DPR	D-PROLINE	P	1MCB	0.75
DPR	D-PROLINE	A,B,C,H,K,L	2R5B	0.75
DPR	D-PROLINE	A	2KDQ	0.75
DPR	D-PROLINE	P	1MCS	0.75
DPR	D-PROLINE	A,B	2AXI	0.75
DPR	D-PROLINE	A	1JY9	0.75
DPR	D-PROLINE	A	2JUE	0.75
DPR	D-PROLINE	P	1MCK	0.75
DPR	D-PROLINE	P	1MCR	0.75
DPR	D-PROLINE	A	2D55	0.75
DPR	D-PROLINE	A	1T8J	0.75
DPR	D-PROLINE	A,B	2EJ6	0.75
DPR	D-PROLINE	P	1MCE	0.75
DPR	D-PROLINE	P	1MCI	0.75
DPR	D-PROLINE	A,B	1SNE	0.75
DPR	D-PROLINE	A,B,C	1QFI	0.75
DPR	D-PROLINE	A,P	1MCD	0.75
DPR	D-PROLINE	A	1ICL	0.75
DPR	D-PROLINE	P	1MCQ	0.75
DPR	D-PROLINE	G,M,P,S	2I5Y	0.75
DPR	D-PROLINE	A,B,C,D	3BOG	0.75
DPR	D-PROLINE	A,L	1ZEA	0.75
DPR	D-PROLINE	A,B	173D	0.75
DPR	D-PROLINE	A,P	1MCJ	0.75
DPR	D-PROLINE	A,B,C	1A7Y	0.75
DPR	D-PROLINE	A	1IC9	0.75
DPR	D-PROLINE	A,B	1JY6	0.75
DPR	D-PROLINE	A	209D	0.75
DPR	D-PROLINE	A	1BFW	0.75
DPR	D-PROLINE	A,B	1O6I	0.75
DPR	D-PROLINE	A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X	1UNJ	0.75
DPR	D-PROLINE	A,B,C,D	2R3C	0.75
DPR	D-PROLINE	A,B,C,D	1I3W	0.75
DPR	D-PROLINE	A	316D	0.75
DPR	D-PROLINE	A,B,C,D	1SN9	0.75
DPR	D-PROLINE	A,B,C,H,K,L	2R5D	0.75
DPR	D-PROLINE	A,B	2Q33	0.75
DPR	D-PROLINE	G,M,P,S	2I60	0.75
DPR	D-PROLINE	A,B	1JY4	0.75
DPR	D-PROLINE	P	1MCF	0.75
DPR	D-PROLINE	A,B,C,D,E,F	1UNM	0.75
DPR	D-PROLINE	A	1ICO	0.75
DPR	D-PROLINE	A,B	1XOF	0.75
DPR	D-PROLINE	P	1MCC	0.75
DPR	D-PROLINE	A,B,C,D	1SNA	0.75
TBM	4-METHYL-4-[(E)-2-BUTENYL]-4,N- DIMETHYL-THREONINE	C	1CWM	0.71
TBM	4-METHYL-4-[(E)-2-BUTENYL]-4,N- DIMETHYL-THREONINE	C	1CWJ	0.71