Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03620620
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 |
CTB | N-2-THIOPHEN-2-YL-ACETAMIDE BORONIC ACID | A,B | 1FSW | 0.73 | |
IOY | P-IODO-D-PHENYLALANINE | A | 1XBU | 0.72 | |
SPA | THIOPHENEACETIC ACID | B | 1AJQ | 0.73 | |
MEA | N-METHYLPHENYLALANINE | A | 2PIL | 0.71 | |
MEA | N-METHYLPHENYLALANINE | A,B,C,D | 1H0I | 0.71 | |
MEA | N-METHYLPHENYLALANINE | A,B,I | 1DOJ | 0.71 | |
CXA | PHENYLALANINE-N-SULFONAMIDE | A | 1IY7 | 0.73 | |
HMF | 2-AMINO-4-PHENYL-BUTYRIC ACID | I,J | 1AY6 | 0.73 | |
HPE | HOMOPHENYLALANINE | A,B | 1B1H | 0.73 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 1O0D | 0.7 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 2FES | 0.7 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | H,P | 2ANK | 0.7 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 2FEQ | 0.7 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | H,P | 2A2X | 0.7 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 1NZQ | 0.7 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 1YYL | 0.7 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 2I5Y | 0.7 | |
THN | 2-[CARBOXY-(2-THIOPHEN-2-YL-ACETYLAMINO)- METHYL]-5-METHYLENE-5,6-DIHYDRO- 2H-[1,3]THIAZINE-4-CARBOXYLIC ACID | A,B | 1KVL | 0.72 | |
DPN | D-PHENYLALANINE | P | 1MCS | 0.74 | |
DPN | D-PHENYLALANINE | A | 1GOE | 0.74 | |
DPN | D-PHENYLALANINE | A | 2RM9 | 0.74 | |
DPN | D-PHENYLALANINE | A | 1SOC | 0.74 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.74 | |
DPN | D-PHENYLALANINE | I | 1ABJ | 0.74 | |
DPN | D-PHENYLALANINE | P | 1DWE | 0.74 | |
DPN | D-PHENYLALANINE | I,M | 1HLT | 0.74 | |
DPN | D-PHENYLALANINE | A,H,L | 1J9C | 0.74 | |
DPN | D-PHENYLALANINE | I,T | 1TMB | 0.74 | |
DPN | D-PHENYLALANINE | A | 2JRY | 0.74 | |
DPN | D-PHENYLALANINE | A | 2SOC | 0.74 | |
DPN | D-PHENYLALANINE | A | 2YYF | 0.74 | |
DPN | D-PHENYLALANINE | I | 2HGT | 0.74 | |
DPN | D-PHENYLALANINE | A,D | 2Q3I | 0.74 | |
DPN | D-PHENYLALANINE | A,P | 1MCD | 0.74 | |
DPN | D-PHENYLALANINE | P | 1HAO | 0.74 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8J | 0.74 | |
DPN | D-PHENYLALANINE | A,B,C | 2PGQ | 0.74 | |
DPN | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.74 | |
DPN | D-PHENYLALANINE | P | 1NRR | 0.74 | |
DPN | D-PHENYLALANINE | I | 1PPB | 0.74 | |
DPN | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.74 | |
DPN | D-PHENYLALANINE | I | 2HPP | 0.74 | |
DPN | D-PHENYLALANINE | B,C | 2OD3 | 0.74 | |
DPN | D-PHENYLALANINE | A | 1B0Q | 0.74 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.74 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8I | 0.74 | |
DPN | D-PHENYLALANINE | H,I,J | 1TMU | 0.74 | |
DPN | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.74 | |
DPN | D-PHENYLALANINE | A | 1GO9 | 0.74 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCF | 0.74 | |
DPN | D-PHENYLALANINE | A | 2RME | 0.74 | |
DPN | D-PHENYLALANINE | H,I | 1TMT | 0.74 | |
DPN | D-PHENYLALANINE | I | 1ABI | 0.74 | |
DPN | D-PHENYLALANINE | R | 1NRQ | 0.74 | |
DPN | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.74 | |
DPN | D-PHENYLALANINE | A,B | 2Q33 | 0.74 | |
DPN | D-PHENYLALANINE | C,H,L | 1DAN | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCE | 0.74 | |
DPN | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.74 | |
DPN | D-PHENYLALANINE | A | 2RMI | 0.74 | |
DPN | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.74 | |
DPN | D-PHENYLALANINE | A | 1W7M | 0.74 | |
DPN | D-PHENYLALANINE | P | 1HAP | 0.74 | |
DPN | D-PHENYLALANINE | A,B | 1ORF | 0.74 | |
DPN | D-PHENYLALANINE | I | 1IHS | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCC | 0.74 | |
DPN | D-PHENYLALANINE | A | 2RMD | 0.74 | |
DPN | D-PHENYLALANINE | A | 2JQB | 0.74 | |
DPN | D-PHENYLALANINE | I | 2HPQ | 0.74 | |
DPN | D-PHENYLALANINE | C,E,F | 1SHH | 0.74 | |
DPN | D-PHENYLALANINE | A,I | 1CVR | 0.74 | |
DPN | D-PHENYLALANINE | L,P | 1AUT | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCI | 0.74 | |
DPN | D-PHENYLALANINE | H,I | 3F6U | 0.74 | |
DPN | D-PHENYLALANINE | A | 1BFW | 0.74 | |
DPN | D-PHENYLALANINE | H,I | 1HAI | 0.74 | |
DPN | D-PHENYLALANINE | B,C | 2THF | 0.74 | |
DPN | D-PHENYLALANINE | I | 1IHT | 0.74 | |
DPN | D-PHENYLALANINE | A,P | 1MCJ | 0.74 | |
DPN | D-PHENYLALANINE | A | 1TKH | 0.74 | |
DPN | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.74 | |
DPN | D-PHENYLALANINE | A | 2FMZ | 0.74 | |
DPN | D-PHENYLALANINE | A | 1YL9 | 0.74 | |
DPN | D-PHENYLALANINE | I | 1HUT | 0.74 | |
DPN | D-PHENYLALANINE | I | 1FXY | 0.74 | |
DPN | D-PHENYLALANINE | A | 1YL8 | 0.74 | |
DPN | D-PHENYLALANINE | C,H,L | 1QFK | 0.74 | |
DPN | D-PHENYLALANINE | P | 1MCB | 0.74 | |
4PH | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.74 | |
1PA | PHENYLMETHYLACETIC ACID ALANINE | I | 1BHF | 0.7 | |
CS3 | S-[3-OXO-3-(2-THIENYL)PROPYL]-L- CYSTEINE | A | 2OQW | 0.8 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A | 3F3C | 0.72 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A,C,E,F | 2UUE | 0.72 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A | 1ZNT | 0.72 | |
PFF | 4-FLUORO-L-PHENYLALANINE | F,H | 1OL1 | 0.72 | |
PFF | 4-FLUORO-L-PHENYLALANINE | A,C,F,H | 2C5V | 0.72 | |
PFF | 4-FLUORO-L-PHENYLALANINE | E,F | 1OL2 | 0.72 | |
4TB | 4-(2-THIENYL)BUTYRIC ACID | A,B | 2AY8 | 0.81 | |
TIH | BETA(2-THIENYL)ALANINE | A | 1MMK | 0.95 | |
TIH | BETA(2-THIENYL)ALANINE | B | 1EOJ | 0.95 | |
TIH | BETA(2-THIENYL)ALANINE | A | 1KW0 | 0.95 | |
TIH | BETA(2-THIENYL)ALANINE | A | 1BDK | 0.95 | |
0A9 | methyl L-phenylalaninate | A | 1AY2 | 0.71 | |
0A9 | methyl L-phenylalaninate | I | 5ER1 | 0.71 | |
0A9 | methyl L-phenylalaninate | I,P | 1HDT | 0.71 | |
TFQ | 4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINE | A | 3D6V | 0.7 | |
APD | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.74 | |
PHI | IODO-PHENYLALANINE | A | 1TF9 | 0.72 | |
PHI | IODO-PHENYLALANINE | A,B,C,D | 1ORW | 0.72 | |
PHI | IODO-PHENYLALANINE | A | 1T6H | 0.72 | |
PHI | IODO-PHENYLALANINE | A,B,C | 1NLU | 0.72 | |
PHI | IODO-PHENYLALANINE | A,I | 1GA1 | 0.72 | |
PHI | IODO-PHENYLALANINE | A,I | 1GA4 | 0.72 | |
PHI | IODO-PHENYLALANINE | P | 1CZI | 0.72 | |
ZAE | N-methyl-D-phenylalanine | H,I,R | 1TBZ | 0.71 |