Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00004370
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
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 |
PYC | PYRROLE-2-CARBOXYLATE | A | 1W62 | 0.78 | |
PYC | PYRROLE-2-CARBOXYLATE | A,B | 1L9D | 0.78 | |
PYC | PYRROLE-2-CARBOXYLATE | A,B | 2CWH | 0.78 | |
PYC | PYRROLE-2-CARBOXYLATE | A,B | 1W61 | 0.78 | |
PYC | PYRROLE-2-CARBOXYLATE | A,B | 1ELI | 0.78 | |
C53 | 2-IMINO-5-(1-PYRIDIN-2-YL-METH- (E)-YLIDENE)-1,3-THIAZOLIDIN-4- ONE | A | 2V0D | 0.7 | |
NCA | NICOTINAMIDE | A,B | 2E5D | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D | 2Z77 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1DMA | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1ISM | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1YC5 | 0.73 | |
NCA | NICOTINAMIDE | A | 2ZB7 | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D,E,F, G,H | 1R15 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2QQG | 0.73 | |
NCA | NICOTINAMIDE | A | 2OTV | 0.73 | |
NCA | NICOTINAMIDE | A | 2QHF | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D | 2C8A | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2HJH | 0.73 | |
NCA | NICOTINAMIDE | A | 2A15 | 0.73 | |
NCA | NICOTINAMIDE | A | 2R6V | 0.73 | |
NCA | NICOTINAMIDE | A,B | 1ISI | 0.73 | |
NCA | NICOTINAMIDE | A,D,E | 2R9J | 0.73 | |
NCA | NICOTINAMIDE | A | 2H4J | 0.73 | |
NCA | NICOTINAMIDE | A,B | 2OD9 | 0.73 | |
NCA | NICOTINAMIDE | A,B,C,D,E | 1YC2 | 0.73 | |
NCA | NICOTINAMIDE | A,B | 3DZG | 0.73 | |
NCA | NICOTINAMIDE | A | 1OJU | 0.73 | |
6PC | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLN | 0.73 | |
6PC | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLO | 0.73 | |
9DG | 9-DEAZAGUANINE | A,B,C,D,E | 1Q2S | 0.71 | |
9DG | 9-DEAZAGUANINE | A | 1IL4 | 0.71 | |
9DG | 9-DEAZAGUANINE | A,C | 1FSG | 0.71 | |
9DG | 9-DEAZAGUANINE | A,B,C,D | 1Q2R | 0.71 | |
I3A | 1H-INDOLE-3-CARBALDEHYDE | A,B,C,D | 3BWL | 0.71 | |
I3A | 1H-INDOLE-3-CARBALDEHYDE | A,B | 2OU3 | 0.71 | |
ISZ | 4-(DIAZENYLCARBONYL)PYRIDINE | A,B,C,D | 1W6F | 0.72 | |
ISZ | 4-(DIAZENYLCARBONYL)PYRIDINE | A | 2V2E | 0.72 | |
ISZ | 4-(DIAZENYLCARBONYL)PYRIDINE | X | 2VCF | 0.72 | |
ISZ | 4-(DIAZENYLCARBONYL)PYRIDINE | A | 2VCS | 0.72 | |
ISZ | 4-(DIAZENYLCARBONYL)PYRIDINE | A | 2VCN | 0.72 | |
ISZ | 4-(DIAZENYLCARBONYL)PYRIDINE | A,B | 1XR3 | 0.72 | |
DMY | DISTAMYCIN A | A | 217D | 0.73 | |
DMY | DISTAMYCIN A | A | 1K2Z | 0.73 | |
DMY | DISTAMYCIN A | A,B,E,F | 2JT7 | 0.73 | |
DMY | DISTAMYCIN A | A,B | 267D | 0.73 | |
DMY | DISTAMYCIN A | A | 306D | 0.73 | |
DMY | DISTAMYCIN A | A | 304D | 0.73 | |
DMY | DISTAMYCIN A | A | 305D | 0.73 | |
DMY | DISTAMYCIN A | A | 1JUX | 0.73 | |
DMY | DISTAMYCIN A | A | 2DND | 0.73 | |
DMY | DISTAMYCIN A | A,B,C,D | 378D | 0.73 | |
DMY | DISTAMYCIN A | B | 1JTL | 0.73 | |
DMY | DISTAMYCIN A | A | 159D | 0.73 | |
DMY | DISTAMYCIN A | A | 216D | 0.73 | |
9HX | 9-DEAZAHYPOXANTHINE | A,B,C | 1I80 | 0.72 | |
286 | 2-ethenyl-1-methylpyridinium | X | 2RC2 | 0.74 | |
PYB | 4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID | A,D,E,G,I,J | 1S32 | 0.73 | |
PYB | 4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID | D,I,J | 1M18 | 0.73 | |
PYB | 4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID | E,I,J | 1M1A | 0.73 | |
PYB | 4-AMINO-(1-METHYLPYRROLE)-2-CARBOXYLIC ACID | E,I,J | 1M19 | 0.73 | |
HLO | 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM | A,B | 2JEY | 0.7 | |
HLO | 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM | A,B | 2JEZ | 0.7 | |
MIB | (3E)-4-(1-METHYL-1H-INDOL-3-YL)BUT- 3-EN-2-ONE | A | 1ZS5 | 0.72 | |
AGE | (2E)-N-hydroxy-3-[1-methyl-4-(phenylacetyl)- 1H-pyrrol-2-yl]prop-2-enamide | A,B,C | 3F07 | 0.72 | |
278 | 1-(1-methyl-1H-pyrrol-2-yl)methanamine | X | 2RBV | 0.78 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2WHQ | 0.71 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2WHP | 0.71 | |
HI6 | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2GYU | 0.71 | |
QNC | 2-CARBONYLQUINOLINE | A,B | 1MTB | 0.71 | |
QNC | 2-CARBONYLQUINOLINE | A,B | 2FGV | 0.71 | |
QNC | 2-CARBONYLQUINOLINE | I | 1IVQ | 0.71 | |
QNC | 2-CARBONYLQUINOLINE | A,B | 2FGU | 0.71 | |
QNC | 2-CARBONYLQUINOLINE | A | 1JLD | 0.71 | |
QNC | 2-CARBONYLQUINOLINE | A,B | 1HXB | 0.71 | |
PBO | 1-PYRIDIN-3-YLBUTAN-1-ONE | A | 1PYJ | 0.73 |