Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02862057
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 |
PNV![]() | (2S,5R,6R)-3,3-DIMETHYL-7-OXO-6- (2-PHENOXYACETAMIDO)-4-THIA-1- AZABICYCLO(3.2.0)HEPTANE- 2-CARBOXYLIC ACID | A,C | 2Z71 | 0.73 | ![]() |
PNV![]() | (2S,5R,6R)-3,3-DIMETHYL-7-OXO-6- (2-PHENOXYACETAMIDO)-4-THIA-1- AZABICYCLO(3.2.0)HEPTANE- 2-CARBOXYLIC ACID | A | 2EX9 | 0.73 | ![]() |
ZED![]() | L-PROLINE, 1-[(2S)-3-MERCAPTO-2- METHYL-1-OXOPROPYL]-4-(PHENYLTHIO)- , 4S | A | 2EWB | 0.76 | ![]() |
CLS![]() | CEPHALOTHIN | A,B | 1KVL | 0.73 | ![]() |
SOX![]() | N-[(2S,4S,6R)-2-(DIHYDROXYMETHYL)- 4-HYDROXY-3,3-DIMETHYL-7-OXO-4LAMBDA~4~- THIA-1-AZABICYCLO[3.2.0]HEPT-6- YL]-2-PHENYLACETAMIDE | B | 1GM8 | 0.83 | ![]() |
SOX![]() | N-[(2S,4S,6R)-2-(DIHYDROXYMETHYL)- 4-HYDROXY-3,3-DIMETHYL-7-OXO-4LAMBDA~4~- THIA-1-AZABICYCLO[3.2.0]HEPT-6- YL]-2-PHENYLACETAMIDE | A,B | 1GM9 | 0.83 | ![]() |
PNN![]() | PENICILLIN G | A,B | 1GM7 | 0.84 | ![]() |
PNN![]() | PENICILLIN G | B | 1FXV | 0.84 | ![]() |
PNN![]() | PENICILLIN G | A | 1UOF | 0.84 | ![]() |
PNN![]() | PENICILLIN G | A | 1UOB | 0.84 | ![]() |
AIC![]() | (2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}- 3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE- 2-CARBOXYLIC ACID | A | 2RDD | 0.82 | ![]() |
AIC![]() | (2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}- 3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE- 2-CARBOXYLIC ACID | A,B,C,D | 1NX9 | 0.82 | ![]() |
AIC![]() | (2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}- 3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE- 2-CARBOXYLIC ACID | A | 1H8S | 0.82 | ![]() |
AIC![]() | (2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}- 3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE- 2-CARBOXYLIC ACID | A | 2EX6 | 0.82 | ![]() |
KCP![]() | 2-[CARBOXY-(2-THIOPHEN-2-YL-ACETYLAMINO)- METHYL]-5-METHYL-3,6-DIHYDRO-2H- [1,3]THIAZINE-4-CARBOXYLIC ACID | A,B | 1KVL | 0.73 | ![]() |
CEP![]() | CEPHALOTHIN GROUP | A | 1CEG | 0.72 | ![]() |
CEP![]() | CEPHALOTHIN GROUP | A | 1IYP | 0.72 | ![]() |
PG1![]() | PENICILLIN G ACYL-SERINE | A,B | 1XA7 | 0.75 | ![]() |
PG1![]() | PENICILLIN G ACYL-SERINE | A | 2IWC | 0.75 | ![]() |
PG1![]() | PENICILLIN G ACYL-SERINE | A,B | 1MWT | 0.75 | ![]() |
T29![]() | TRI166 (BIFUNCTIONAL BORONATE INHIBITOR) | H | 1A3B | 0.7 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 1GHP | 0.76 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 1PWC | 0.76 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 1IYQ | 0.76 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 1FQG | 0.76 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A,B,C,D | 2J8Y | 0.76 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A,B,C,D | 2JBF | 0.76 | ![]() |
PNM![]() | OPEN FORM - PENICILLIN G | A | 2EX8 | 0.76 | ![]() |
G23![]() | (2R,4S)-2-[(R)-BENZYLCARBAMOYL- PHENYLACETYL-METHYL]-5,5-DIMETHYL- THIAZOLIDINE-4-CARBOXYLIC ACID | A | 1HTE | 0.74 | ![]() |
PN1![]() | (2S,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}- 3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE- 2-CARBOXYLIC ACID | A | 1W2N | 0.82 | ![]() |
PN1![]() | (2S,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}- 3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE- 2-CARBOXYLIC ACID | A | 1UNB | 0.82 | ![]() |
TST![]() | 4-METHYL-2-{[4-(TOLUENE-4-SULFONYL)- THIOMORPHOLINE-3-CARBONYL]-AMINO}- PENTANOIC ACID | A | 1J4I | 0.75 | ![]() |
GSB![]() | S-BENZYL-GLUTATHIONE | A,B,C,D | 1FRO | 0.73 | ![]() |
GSB![]() | S-BENZYL-GLUTATHIONE | A,B,C,D | 1GUH | 0.73 | ![]() |
GBI![]() | S-(3-IODOBENZYL)GLUTATHIONE | A | 2GSQ | 0.72 | ![]() |
IBG![]() | GAMMA-GLUTAMYL[S-(2-IODOBENZYL)CYSTEINYL]GLYCINE | A | 1M9B | 0.72 | ![]() |
TI1![]() | [2(R,S)-2-SULFANYLHEPTANOYL]-PHE- ALA | A | 1R1I | 0.71 | ![]() |
TI1![]() | [2(R,S)-2-SULFANYLHEPTANOYL]-PHE- ALA | A | 1QF1 | 0.71 | ![]() |
CED![]() | 5-METHYL-2-[2-OXO-1-(2-THIOPHEN- 2-YL-ACETYLAMINO)-ETHYL]-3,6-DIHYDRO- 2H-[1,3]THIAZINE-4-CARBOXYLIC ACID | A | 1GHM | 0.72 | ![]() |