Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02313658
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 |
DPN![]() | D-PHENYLALANINE | P | 1MCS | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1GOE | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RM9 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1SOC | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1ABJ | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1DWE | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I,M | 1HLT | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,H,L | 1J9C | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I,T | 1TMB | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2JRY | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2SOC | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2YYF | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HGT | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,D | 2Q3I | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,P | 1MCD | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1HAO | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1Z8J | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,C | 2PGQ | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1NRR | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1PPB | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HPP | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C | 2OD3 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1B0Q | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1Z8I | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I,J | 1TMU | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1GO9 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCF | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RME | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 1TMT | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1ABI | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | R | 1NRQ | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B | 2Q33 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L | 1DAN | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCE | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RMI | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1W7M | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1HAP | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,B | 1ORF | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1IHS | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCC | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2RMD | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2JQB | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 2HPQ | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | C,E,F | 1SHH | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,I | 1CVR | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | L,P | 1AUT | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCI | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 3F6U | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1BFW | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | H,I | 1HAI | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | B,C | 2THF | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1IHT | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A,P | 1MCJ | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1TKH | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 2FMZ | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1YL9 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1HUT | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | I | 1FXY | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | A | 1YL8 | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | C,H,L | 1QFK | 0.72 | ![]() |
DPN![]() | D-PHENYLALANINE | P | 1MCB | 0.72 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A,B,C,D | 2APJ | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1IAV | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A,B | 1IEC | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1ZIY | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1C9N | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1ZJ4 | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1GGV | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1Q5P | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1PQA | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1ZJ5 | 0.77 | ![]() |
SEB![]() | O-BENZYLSULFONYL-SERINE | A | 1C9M | 0.77 | ![]() |
APD![]() | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.71 | ![]() |
MEA![]() | N-METHYLPHENYLALANINE | A | 2PIL | 0.76 | ![]() |
MEA![]() | N-METHYLPHENYLALANINE | A,B,C,D | 1H0I | 0.76 | ![]() |
MEA![]() | N-METHYLPHENYLALANINE | A,B,I | 1DOJ | 0.76 | ![]() |
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 | ![]() |
TI1![]() | [2(R,S)-2-SULFANYLHEPTANOYL]-PHE- ALA | A | 1R1I | 0.75 | ![]() |
TI1![]() | [2(R,S)-2-SULFANYLHEPTANOYL]-PHE- ALA | A | 1QF1 | 0.75 | ![]() |
HPE![]() | HOMOPHENYLALANINE | A,B | 1B1H | 0.72 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 1GHP | 0.73 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 1PWC | 0.73 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 1IYQ | 0.73 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 1FQG | 0.73 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A,B,C,D | 2J8Y | 0.73 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A,B,C,D | 2JBF | 0.73 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 2EX8 | 0.73 | ![]() |
BCS![]() | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.88 | ![]() |
BCS![]() | BENZYLCYSTEINE | A | 1EH8 | 0.88 | ![]() |
HMF![]() | 2-AMINO-4-PHENYL-BUTYRIC ACID | I,J | 1AY6 | 0.72 | ![]() |
OIR![]() | N-(3-PHENYL-2-SULFANYLPROPANOYL)PHENYLALANYLALANINE | A | 1R1J | 0.74 | ![]() |
FBD![]() | N-({(1R)-1-carboxy-2-[(4-fluorobenzyl)sulfanyl]ethyl}carbamoyl)- L-glutamic acid | A | 3D7D | 0.74 | ![]() |
RRT![]() | (R)-RETRO-THIORPHAN | E | 1Z9G | 0.74 | ![]() |
S2D![]() | N-BENZOYL-D-ALANINE | A,B | 2JCI | 0.7 | ![]() |
TIO![]() | (2-MERCAPTOMETHYL-3-PHENYL-PROPIONYL)- GLYCINE | E | 1ZDP | 0.75 | ![]() |
BBL![]() | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A,I | 2H9H | 0.71 | ![]() |
BBL![]() | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A,I | 2HAL | 0.71 | ![]() |
BBL![]() | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A | 2A4O | 0.71 | ![]() |
BBL![]() | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A,I | 2H6M | 0.71 | ![]() |
BBL![]() | N-[(BENZYLOXY)CARBONYL]-L-ALANINE | A | 2CXV | 0.71 | ![]() |
ING![]() | D-[(AMINO)CARBONYL]PHENYLALANINE | A,B | 1UF8 | 0.71 | ![]() |
ING![]() | D-[(AMINO)CARBONYL]PHENYLALANINE | A,B,D,E | 1HDU | 0.71 | ![]() |
GBI![]() | S-(3-IODOBENZYL)GLUTATHIONE | A | 2GSQ | 0.73 | ![]() |
4PH![]() | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.71 | ![]() |
IBG![]() | GAMMA-GLUTAMYL[S-(2-IODOBENZYL)CYSTEINYL]GLYCINE | A | 1M9B | 0.73 | ![]() |
MPQ![]() | N-METHYL-ALPHA-PHENYL-GLYCINE | D | 1D6E | 0.71 | ![]() |
R1F![]() | 3-{[(2,2,5,5-TETRAMETHYL-1-OXO- 4-PHENYL-2,5-DIHYDRO-1H-PYRROLIUM- 3-YL)METHYL]DISULFANYL}-D-ALANINE | A | 1ZUR | 0.75 | ![]() |
NDF![]() | N-(CARBOXYCARBONYL)-D-PHENYLALANINE | A | 1YCI | 0.7 | ![]() |
TST![]() | 4-METHYL-2-{[4-(TOLUENE-4-SULFONYL)- THIOMORPHOLINE-3-CARBONYL]-AMINO}- PENTANOIC ACID | A | 1J4I | 0.72 | ![]() |
PBB![]() | S-(4-BROMOBENZYL)CYSTEINE | A,B,C,D | 1AQV | 0.8 | ![]() |
GSB![]() | S-BENZYL-GLUTATHIONE | A,B,C,D | 1FRO | 0.75 | ![]() |
GSB![]() | S-BENZYL-GLUTATHIONE | A,B,C,D | 1GUH | 0.75 | ![]() |
G23![]() | (2R,4S)-2-[(R)-BENZYLCARBAMOYL- PHENYLACETYL-METHYL]-5,5-DIMETHYL- THIAZOLIDINE-4-CARBOXYLIC ACID | A | 1HTE | 0.7 | ![]() |
PNN![]() | PENICILLIN G | A,B | 1GM7 | 0.71 | ![]() |
PNN![]() | PENICILLIN G | B | 1FXV | 0.71 | ![]() |
PNN![]() | PENICILLIN G | A | 1UOF | 0.71 | ![]() |
PNN![]() | PENICILLIN G | A | 1UOB | 0.71 | ![]() |
ZAE![]() | N-methyl-D-phenylalanine | H,I,R | 1TBZ | 0.76 | ![]() |
KEL![]() | N-[(2R)-2-benzyl-4-(hydroxyamino)- 4-oxobutanoyl]-L-alanine | X | 3B7U | 0.7 | ![]() |