Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813149
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 |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.78 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.74 | |
PPN | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.71 | |
DNT | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.81 | |
NCR | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.79 | |
NIY | META-NITRO-TYROSINE | A | 2ADP | 0.85 | |
NIY | META-NITRO-TYROSINE | A | 3DIV | 0.85 | |
NIY | META-NITRO-TYROSINE | A | 2H5U | 0.85 | |
NIY | META-NITRO-TYROSINE | A | 1K4Q | 0.85 | |
NIY | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.85 | |
TNF | PICRIC ACID | A | 1GVS | 0.76 | |
TNF | PICRIC ACID | X | 1VYP | 0.76 | |
TNF | PICRIC ACID | A | 1VYR | 0.76 | |
TNF | PICRIC ACID | X | 1VYS | 0.76 | |
NPA | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.91 | |
TYQ | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6Y | 0.74 | |
TYQ | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6U | 0.74 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.76 | |
DNC | 3,5-DINITROCATECHOL | A | 3BWY | 0.71 | |
DNC | 3,5-DINITROCATECHOL | A | 3BWM | 0.71 | |
DNC | 3,5-DINITROCATECHOL | A | 1VID | 0.71 | |
HAB | A,B | 1SRE | 0.7 | ||
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.76 | |
BIE | (3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE | A,B | 2CL5 | 0.72 | |
DNF | 2,4-DINITROPHENOL | A,B | 2B16 | 0.76 | |
DNF | 2,4-DINITROPHENOL | H,J,L,N | 1OAU | 0.76 | |
DNF | 2,4-DINITROPHENOL | A | 1GVO | 0.76 | |
DNF | 2,4-DINITROPHENOL | A,B | 2B15 | 0.76 | |
DNF | 2,4-DINITROPHENOL | A,B | 2B14 | 0.76 | |
NTD | 2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE | A,B | 1T47 | 0.71 | |
P28 | 3',5'-DINITRO-N-ACETYL-L-THYRONINE | A,B | 2ROY | 0.71 | |
ANX | 2,5-DINITROPHENOL | A,B,C,D,E,F, G,H | 2BFG | 0.72 | |
NPC | 4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION | H,I,J | 1A6V | 0.82 | |
ST1 | 4-(ACETYLAMINO)-3-HYDROXY-5-NITROBENZOIC ACID | A,B | 1IVD | 0.71 | |
ST1 | 4-(ACETYLAMINO)-3-HYDROXY-5-NITROBENZOIC ACID | A | 1IVB | 0.71 | |
BRS | 2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6- DINITRO-PHENOL | A,B,D,M,N,O,P | 1KFY | 0.74 | |
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.78 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.71 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.71 | |
LVS | 4-IODO-3-NITROPHENYL ACETYL-LEUCINYL- LEUCINYL-LEUCINYL-VINYLSULFONE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R, S,T,U,V,W,X | 1KYI | 0.71 | |
LVS | 4-IODO-3-NITROPHENYL ACETYL-LEUCINYL- LEUCINYL-LEUCINYL-VINYLSULFONE | A,B,C,G,H,I, L,M,N | 1OFI | 0.71 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.77 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.7 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.7 | |
NIP | 4-HYDROXY-5-IODO-3-NITROPHENYLACETYL- EPSILON-AMINOCAPROIC ACID ANION | H | 1A6W | 0.82 | |
MHB | A,B | 1SRG | 0.7 | ||
PRQ | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.71 |