Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02274670
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 |
AHU | 1',5'-ANHYDRO-2',3'-DIDEOXY-2'- (5-IODOURACIL-1-YL)-D-ABABINO-HEXITOL | A,B | 1KI6 | 0.74 | |
6CT | PHOSPHORIC ACID MONO-[5-HYDROXYMETHYL- 2-METHYL-3-THYMINYL-CYCLOPENTYLMETHYL]ESTER GROUP | A,B | 1DAU | 0.74 | |
AZZ | 3'-azido-3'-deoxythymidine | A,B,C,D | 2JJ8 | 0.75 | |
AZZ | 3'-azido-3'-deoxythymidine | A | 3B9L | 0.75 | |
AZZ | 3'-azido-3'-deoxythymidine | A | 3B9M | 0.75 | |
AZZ | 3'-azido-3'-deoxythymidine | A | 3BCR | 0.75 | |
T39 | A,B | 411D | 0.7 | ||
THM | THYMIDINE | A,B | 1W2G | 0.74 | |
THM | THYMIDINE | A | 3EXK | 0.74 | |
THM | THYMIDINE | A,B,C,D,E,F, G,H | 1G0R | 0.74 | |
THM | THYMIDINE | A | 3BCU | 0.74 | |
THM | THYMIDINE | A,B | 1P72 | 0.74 | |
THM | THYMIDINE | A,B,C,D,E,F, G,H | 1ZMX | 0.74 | |
THM | THYMIDINE | A,B | 1P6X | 0.74 | |
THM | THYMIDINE | A,B | 2QQE | 0.74 | |
THM | THYMIDINE | A,B | 2QQ0 | 0.74 | |
THM | THYMIDINE | A,B,C,D,E,F, G,H | 1OT3 | 0.74 | |
THM | THYMIDINE | A | 3H5Q | 0.74 | |
THM | THYMIDINE | A,B | 1E2J | 0.74 | |
THM | THYMIDINE | A,B,C,D | 1H5R | 0.74 | |
THM | THYMIDINE | A | 2Z1A | 0.74 | |
THM | THYMIDINE | A,B | 1TLW | 0.74 | |
THM | THYMIDINE | A | 2VTK | 0.74 | |
THM | THYMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R | 1RXU | 0.74 | |
THM | THYMIDINE | A,B | 1KIM | 0.74 | |
THM | THYMIDINE | A,B | 1P7C | 0.74 | |
THM | THYMIDINE | A,B,C,D | 2B8T | 0.74 | |
THM | THYMIDINE | A | 2J9R | 0.74 | |
ADT | 3'-DEOXY-3'-ACETAMIDO-THYMIDINE | A,B | 8RSA | 0.76 | |
T32 | A,B | 290D | 0.74 | ||
SCT | (SOUTH)-METHANOCARBA-THYMIDINE | A,B | 1OF1 | 0.76 | |
XTL | [(1S,4R,6R)-6-HYDROXY-4-(THYMIN- 9-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE | A,B | 2H0N | 0.73 | |
CKB | 1-beta-D-glucopyranosyl-5-methylpyrimidine- 2,4(1H,3H)-dione | A | 3BD7 | 0.8 | |
HDP | [(1S,6S)-6-HYDROXY-4-(5-METHYL- 2,4-DIOXO-3,4-DIHYDROPYRIMIDIN- 1(2H)-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE | A | 1U01 | 0.73 | |
T3S | 5'-deoxy-5'-piperidin-1-ylthymidine | A | 3D8Y | 0.76 | |
ZTH | (S)-1'-(2',3'-DIHYDROXYPROPYL)- THYMINE | A | 2JJA | 0.74 | |
T66 | 2-AMINOETHYLLYSINE-CARBONYLMETHYLENE- THYMINE | B | 1NR8 | 0.76 | |
TCP | 5'-METHYLTHYMIDINE | A,B,C,D,I,K | 1TEZ | 0.74 | |
TCP | 5'-METHYLTHYMIDINE | A | 1AC3 | 0.74 | |
2BT | 2'-O-BUTYL-THYMIDINE | A,B | 1WV6 | 0.7 | |
2BT | 2'-O-BUTYL-THYMIDINE | A,B | 1WV5 | 0.7 | |
TMC | 1-[4-HYDROXY-5-(HYDROXYMETHYL)BICYCLO[3.1.0]HEX- 2-YL]-5-METHYLPYRIMIDINE-2,4(1H,3H)- DIONE | A,B | 1E2K | 0.77 | |
TMC | 1-[4-HYDROXY-5-(HYDROXYMETHYL)BICYCLO[3.1.0]HEX- 2-YL]-5-METHYLPYRIMIDINE-2,4(1H,3H)- DIONE | A,B | 1E2L | 0.77 | |
3ME | PHOSPHORIC ACID MONO-[4-[2-(2-DIMETHYLAMINO- ETHOXY)-ETHOXY]-3-HYDROXY-5- (5- METHYL-2,4-DIOXO-3,4-DIHYDRO-2H- PYRIMIDIN-1-YL)-TETRAHYDRO-FURAN- 2-YLMETHYL] ESTER | A,B | 1NZG | 0.71 | |
6HT | 1',5'-ANHYDRO-2',3'-DIDEOXY-2'- (THYMIN-1-YL)-6'-O-PHOSPHORYL-D- ARABINO-HEXITOL | A | 1D7Z | 0.77 | |
6HT | 1',5'-ANHYDRO-2',3'-DIDEOXY-2'- (THYMIN-1-YL)-6'-O-PHOSPHORYL-D- ARABINO-HEXITOL | A,B | 1EC4 | 0.77 | |
6HT | 1',5'-ANHYDRO-2',3'-DIDEOXY-2'- (THYMIN-1-YL)-6'-O-PHOSPHORYL-D- ARABINO-HEXITOL | B | 1EJZ | 0.77 | |
6HT | 1',5'-ANHYDRO-2',3'-DIDEOXY-2'- (THYMIN-1-YL)-6'-O-PHOSPHORYL-D- ARABINO-HEXITOL | A,B,C,D,E,G | 2BJ6 | 0.77 | |
6HT | 1',5'-ANHYDRO-2',3'-DIDEOXY-2'- (THYMIN-1-YL)-6'-O-PHOSPHORYL-D- ARABINO-HEXITOL | A | 481D | 0.77 | |
T41 | B | 214D | 0.7 | ||
U2L | A | 1XV6 | 0.71 | ||
PST | THYMIDINE-5'-THIOPHOSPHATE | A,B | 1KSP | 0.7 | |
PST | THYMIDINE-5'-THIOPHOSPHATE | A | 219D | 0.7 | |
PST | THYMIDINE-5'-THIOPHOSPHATE | A | 8PSH | 0.7 | |
PST | THYMIDINE-5'-THIOPHOSPHATE | A,B | 1KRP | 0.7 | |
TXS | 1-(2,5-dideoxy-5-pyrrolidin-1-yl- beta-L-erythro-pentofuranosyl)- 5-methylpyrimidine-2,4(1H,3H)-dione | A,B | 3D8Z | 0.74 | |
2MU | 2',5-DIMETHYLURIDINE-5'-MONOPHOSPHATE | A,B | 1PWF | 0.7 | |
2MU | 2',5-DIMETHYLURIDINE-5'-MONOPHOSPHATE | A | 1FIR | 0.7 | |
MMT | 5'-O-(DIMETHYLAMINO)-THYMIDINE | A | 1CX5 | 0.73 | |
5AT | 5'-AMINO-5'-DEOXYTHYMIDINE | A,B | 1KSE | 0.74 | |
5AT | 5'-AMINO-5'-DEOXYTHYMIDINE | A,B | 1C95 | 0.74 | |
5AT | 5'-AMINO-5'-DEOXYTHYMIDINE | A,B | 1ON5 | 0.74 | |
P2T | A,B | 1Y8V | 0.7 | ||
XTH | 1-(2,3-DIDEOXY-6-O-PHOSPHONO-BETA- D-ERYTHRO-HEXOPYRANOSYL)-5-METHYLPYRIMIDINE- 2,4(1H,3H)-DIONE | A,B | 2H9S | 0.74 | |
5MU | A,B,C,D | 1IL2 | 0.7 | ||
5MU | V,Y,Z | 2WDG | 0.7 | ||
5MU | C,D | 1MJ1 | 0.7 | ||
5MU | A | 1I9V | 0.7 | ||
5MU | A,B,C,D,E,F | 1TTT | 0.7 | ||
5MU | X,Y | 2DLC | 0.7 | ||
5MU | P,R | 1B23 | 0.7 | ||
5MU | A,B,C,D,E,F | 1OB5 | 0.7 | ||
5MU | V,Z | 2J02 | 0.7 | ||
5MU | A,B | 1F7U | 0.7 | ||
5MU | A | 2Z9Q | 0.7 | ||
5MU | B,C,D | 1ZZN | 0.7 | ||
5MU | A | 2TRA | 0.7 | ||
5MU | A,B,R,S | 1ASZ | 0.7 | ||
5MU | A | 1EHZ | 0.7 | ||
5MU | M,N | 1EQQ | 0.7 | ||
5MU | A,B,T | 1H4Q | 0.7 | ||
5MU | A | 6TNA | 0.7 | ||
5MU | V,Y,Z | 3FIC | 0.7 | ||
5MU | V,Y,Z | 2WDH | 0.7 | ||
5MU | V,Z | 2J00 | 0.7 | ||
5MU | T | 1SER | 0.7 | ||
5MU | B,C,D | 1JGP | 0.7 | ||
5MU | C,D | 3BT7 | 0.7 | ||
5MU | A | 4TNA | 0.7 | ||
5MU | W,Z | 2V46 | 0.7 | ||
5MU | C,D | 1EFW | 0.7 | ||
5MU | W,Z | 2V48 | 0.7 | ||
5MU | B,D | 1U6B | 0.7 | ||
5MU | A | 1EVV | 0.7 | ||
5MU | 0,Y,Z | 2OW8 | 0.7 | ||
5MU | A,B,T | 1H4S | 0.7 | ||
5MU | A,B | 3DEG | 0.7 | ||
5MU | A | 3CW6 | 0.7 | ||
5MU | A | 1TRA | 0.7 | ||
5MU | A | 3CW5 | 0.7 | ||
5MU | V,Z | 3FIH | 0.7 | ||
5MU | B | 1F7V | 0.7 | ||
5MU | A | 3TRA | 0.7 | ||
5MU | Z | 3BBV | 0.7 | ||
5MU | B,C,D | 1JGQ | 0.7 | ||
5MU | B | 1ML5 | 0.7 | ||
5MU | A,B,C,D,E | 1FCW | 0.7 | ||
5MU | R,S | 1ASY | 0.7 | ||
5MU | A | 1KOS | 0.7 | ||
5MU | B,C,D | 1GIX | 0.7 | ||
5MU | T | 1GSG | 0.7 | ||
5MU | A,B | 1QF6 | 0.7 | ||
5MU | A,B | 1H3E | 0.7 | ||
5MU | M | 2OM7 | 0.7 | ||
5MU | A,B | 1C0A | 0.7 | ||
5MU | O | 1EG0 | 0.7 | ||
5MU | B,C,D | 1JGO | 0.7 | ||
5MU | B | 1C2W | 0.7 | ||
5MU | B,D,F,H | 2CZJ | 0.7 | ||
5MU | C,D | 2FMT | 0.7 | ||
5MU | A | 4TRA | 0.7 | ||
5MU | A | 1TN2 | 0.7 | ||
5MU | E,F | 1SZ1 | 0.7 | ||
5MU | A,C,E,F | 486D | 0.7 | ||
CJB | 1-beta-D-glucopyranosylpyrimidine- 2,4(1H,3H)-dione | A | 3BCS | 0.7 | |
T48 | A,B | 291D | 0.77 |