MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02501512

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
GDM	GELDANAMYCIN	A	1YET	0.72
BID	BISTRAMIDE A	A	2FXU	0.72
FK5	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN	A	2FKE	0.75
FK5	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN	A	1FKF	0.75
FK5	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN	A,B,C	1TCO	0.75
FK5	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN	A,B	1Q6I	0.75
FK5	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN	A	1FKJ	0.75
FK5	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN	A,B	2VN1	0.75
FK5	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN	A	1YAT	0.75
FK5	8-DEETHYL-8-[BUT-3-ENYL]-ASCOMYCIN	A	1BKF	0.75
KOS	17-DESMETHOXY-17-N,N-DIMETHYLAMINOETHYLAMINO- GELDANAMYCIN	A	1OSF	0.78
CNP	2-PROPENYL-N-ACETYL-NEURAMIC ACID	A	4SLI	0.71
IGC	N-[(1S,2R,3E)-1-({[ALPHA-D-GALACTOPYRANOSYL- (1->3)-BETA-D-GALACTOPYRANOSYL- (1->4)-BETA-D-GLUCOPYRANOSYL]OXY}METHYL)- 2-HYDROXYHEPTADEC-3-EN-1-YL]OCTANAMIDE	A,C	2Q7Y	0.7
RAD	C49-METHYL RAPAMYCIN	A	2FAP	0.76
RAD	C49-METHYL RAPAMYCIN	A	1NSG	0.76
818	18-HYDROXYASCOMYCIN	A	1FKD	0.75
STD	STREPTOLYDIGIN	D,M,N	1ZYR	0.71
STD	STREPTOLYDIGIN	D,N	2A6H	0.71
STD	STREPTOLYDIGIN	D,M,N	2PPB	0.71
GMY	GELDANAMYCIN	A	2ESA	0.72
GMY	GELDANAMYCIN	A	2WEQ	0.72
GMY	GELDANAMYCIN	A,B	2EXL	0.72
GMY	GELDANAMYCIN	A	1A4H	0.72
GMY	GELDANAMYCIN	A	3C11	0.72
G39	5-N-ACETYL-3-(1-ETHYLPROPYL)-1- CYCLOHEXENE-1-CARBOXYLIC ACID	A	2QWH	0.71
G39	5-N-ACETYL-3-(1-ETHYLPROPYL)-1- CYCLOHEXENE-1-CARBOXYLIC ACID	A	3CL0	0.71
G39	5-N-ACETYL-3-(1-ETHYLPROPYL)-1- CYCLOHEXENE-1-CARBOXYLIC ACID	A	2QWK	0.71
G39	5-N-ACETYL-3-(1-ETHYLPROPYL)-1- CYCLOHEXENE-1-CARBOXYLIC ACID	A,B,C,D,E,F, G,H	3CL2	0.71
G39	5-N-ACETYL-3-(1-ETHYLPROPYL)-1- CYCLOHEXENE-1-CARBOXYLIC ACID	A	2HT8	0.71
G39	5-N-ACETYL-3-(1-ETHYLPROPYL)-1- CYCLOHEXENE-1-CARBOXYLIC ACID	A	2HT7	0.71
G39	5-N-ACETYL-3-(1-ETHYLPROPYL)-1- CYCLOHEXENE-1-CARBOXYLIC ACID	B	2HU0	0.71
G39	5-N-ACETYL-3-(1-ETHYLPROPYL)-1- CYCLOHEXENE-1-CARBOXYLIC ACID	A,B,C,D,E,F, G,H	2HU4	0.71
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	2DG3	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	1PBK	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	2	1Z58	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	2DG9	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	1C9H	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	1FKB	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	1FAP	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	1FKL	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	2DG4	0.76
RAP	RAPAMYCIN IMMUNOSUPPRESSANT DRUG	A	2VCD	0.76
CYV	ETHYL (4R)-4-{[(2R,5S)-5-{[N-(TERT- BUTOXYCARBONYL)-L-SERYL]AMINO}- 6-METHYL-2-(3-METHYLBUT-2-EN-1- YL)-4-OXOHEPTANOYL]AMINO}-5-[(3R)- 2-OXOPYRROLIDIN-3-YL]PENTANOATE	A	2QIQ	0.7
KIR	KIRROMYCIN	A,B	1OB2	0.7